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1 otype in HeLa cells, implicating Glu431 as a catalytic residue.
2 of O-fucose in a specific orientation to the catalytic residue.
3 it into the active site until it reaches the catalytic residue.
4 between Cys192, on this helix, and Cys138, a catalytic residue.
5 enesis has confirmed the role of Lys144 as a catalytic residue.
6 during the nucleophilic attack by the Ser278 catalytic residue.
7 is residue to serve as the general acid/base catalytic residue.
8 411 residues contain 70 of the annotated 111 catalytic residues.
9 es, neural networks were trained to identify catalytic residues.
10 e core fold of this enzymatic domain and its catalytic residues.
11 intrinsically disordered proteins (IDPs) and catalytic residues.
12 oved relative pK(a) predictions for proximal catalytic residues.
13 d mutagenesis was carried out to confirm the catalytic residues.
14 oid-like pseudoproteases that lack essential catalytic residues.
15 2, indicating the relative importance of the catalytic residues.
16 intramembrane serine proteases that lack key catalytic residues.
17 as well as altering the positions of certain catalytic residues.
18 due to misalignment of the substrate and/or catalytic residues.
19 rate specifically though the loss or gain of catalytic residues.
20 This function is independent of the putative catalytic residues.
21 ure of VopS and its evolutionarily conserved catalytic residues.
22 sertions at second-shell sites that abut key catalytic residues.
23 to Sts-1(PGM), including conservation of all catalytic residues.
24 ly as a dimer with each subunit contributing catalytic residues.
25 and acts as a switch to correctly orient key catalytic residues.
26 the role and relative importance of putative catalytic residues.
27 ional flexibility, which could encompass the catalytic residues.
28 es only three polar side chains as potential catalytic residues.
29 hat hindered binding or accessibility to the catalytic residues.
30 s provide improved ranked positions of known catalytic residues.
31 mplicate histidine 45 and arginine 70 as key catalytic residues.
32 e Lys to Arg mutation significantly distorts catalytic residues.
33 ributed effects that propagate long-range to catalytic residues.
34 probe the functional roles of such putative catalytic residues.
35 degree of sequence identity around the four catalytic residues.
36 ydrolysis of the polysaccharide close to the catalytic residues.
37 ational analysis, we confirmed the essential catalytic residues.
38 r chemotype, which did not interact with the catalytic residues.
39 nal studies in their efforts to characterize catalytic residues.
40 elations, as well as the solvent exposure of catalytic residues.
41 on the basis of distance restraints between catalytic residues.
42 AMP share conserved secondary structures and catalytic residues.
43 cterial DHNAs, except when using alternative catalytic residues.
44 aining (pro) sequences, yet retain essential catalytic residues.
45 equence analysis allowed us to identify four catalytic residues, a proton relay cascade, and a substr
46 s shows that by decoupling the action of the catalytic residues acting on each strand we can inhibit
48 eral C(t)-FDH mutants in which two essential catalytic residues adjacent to the nicotinamide ring of
51 enesis experiments suggest that YjgF lacks a catalytic residue and that it facilitates ammonia releas
52 [with the underlined histidine acting as the catalytic residue and the underlined serine as the nucle
53 (i) a water molecule frequently bridges the catalytic residues and (ii) the bridging water molecule
54 trinsically active kinase conformation, with catalytic residues and a catalytic mechanism remarkably
56 (beta1, beta2, and beta5) bear the protease catalytic residues and are synthesized with N-terminal p
58 and TgtA2 reveal that TgtA2 lacks key arcTGT catalytic residues and contains an additional module.
60 show that Thr 42, Glu 50, and His 76 are key catalytic residues and identify several factors that inf
61 arge-scale breathing motion that exposes key catalytic residues and lowers the hydrophobicity of the
62 logues, forming putative hydrogen bonds with catalytic residues and mimicking the charge distribution
63 8 are proposed to position appropriately the catalytic residues and participate in substrate binding.
64 evaluated INTREPID on two tasks: predicting catalytic residues and predicting specificity determinan
65 ted mutagenesis of RadH was used to identify catalytic residues and provide insight into the mechanis
67 chain binding, (2) the atypical active site catalytic residues and surrounding oxyanion hole that co
69 lation reaction the same active site and one catalytic residue, and utilizes molecular oxygen as sour
70 ies revealed that Asp(202) and Glu(361) were catalytic residues, and Trp(270), Tyr(461), and Asn(462)
72 studies, which revealed that the motions of catalytic residues are constrained by the second C-extei
74 edge base, we have seen that the top 10 most catalytic residues are histidine, aspartate, glutamate,
79 hereas saphire mutants lacking key conserved catalytic residues are viable but thermosensitive, sugge
80 an enzymatic reaction, but these so-called 'catalytic residues' are embedded in extensive interactio
81 sites in protein-protein interfaces, unlike catalytic residues, are only weakly conserved and induce
83 uced structural alignment or misalignment of catalytic residues as a third dimension on the free-ener
84 aking into account the local conformation of catalytic residues as well as protein dynamics during th
85 have unique three-dimensional structures and catalytic residues as well as specific tissue localizati
86 ural studies confirmed the importance of key catalytic residues as well as the importance of residues
87 horylated reaction cycle intermediate at the catalytic residue Asp-488, whereas, among all plant nutr
89 sis of this structure-function analysis, the catalytic residues Asp11, Asp13, Thr113, and Lys147 as w
90 that CSmetaPred_poc is able to rank putative catalytic residues at lower (better) ranked positions, w
92 vided into donor and acceptor sites with the catalytic residues at their junction; a number of loops
93 for the first time detailed knowledge about catalytic residues, available through the Catalytic Site
94 kernel-based algorithm for the prediction of catalytic residues based on protein sequence, structure
95 Smaller amplicons, lacking hyaluronidase catalytic residues because of 768 bp or 855 bp central d
97 n mutant versions of hOGG1 having changes in catalytic residues but not on variants having altered 7,
98 s S(N)2 reaction, His-374 and Asn-397 act as catalytic residues by enhancing the nucleophilicity of t
100 effect", whereby mutations in peripheral non-catalytic residues can cause subtle allosteric changes i
103 whilst the differences between EC classes in catalytic residue composition are not immediately obviou
105 erminal domain, and it identified additional catalytic residues conserved throughout eukaryotic RNase
106 onclude that factors other than first-sphere catalytic residue contacts contribute to binding of inhi
107 otonation state for the substrate and nearby catalytic residues could be uniquely distinguished by th
110 the active-site loop and the position of the catalytic residue Cys75 are unchanged with respect to th
111 However, replacement of conserved putative catalytic residues (D(321), R(324), and Q(330)) had no e
114 linker, located more than 11 A away from the catalytic residues, determines the fidelity of these Y-f
116 ggesting that the spatial arrangement of the catalytic residues does not change during the dephosphor
117 wever, both NF90 and NF45 have lost critical catalytic residues during evolution and are therefore no
118 often be generated by mutating the canonical catalytic residue (e.g. Ras Q61L) to impair GTP hydrolys
119 Changes in the positioning of conserved catalytic residues (e.g. Lys-73, Ser-130, and Tyr-105) a
123 C10 peptide binding blocks access to OASS catalytic residues, explaining how complex formation dow
124 nts lacking either its RNA-binding domain or catalytic residue fail to promote synapse formation, sug
125 Ras superfamily of GTPases, lacks a defined catalytic residue for carrying out guanosine triphosphat
126 conserved histidine (H225) functions as the catalytic residue for this enzymatic activity, and mutat
131 teins, but it does not contain the motifs of catalytic residues found in these structural homologues.
133 is stabilized by polar interactions with the catalytic residue Glu(226) rather than by a covalent lin
135 used to explore the interaction of the CD38 catalytic residue Glu-226 with the "northern" ribose.
136 expected, the results provided evidence that catalytic residue Glu-44 of SpoIVFB is near the cleavage
138 intermediate formed a close linkage with the catalytic residue (Glu-179), whereas the adenine ring at
139 onent, in which the PIWI domain provides the catalytic residues governing guide-strand mediated site-
140 As a result, the computational prediction of catalytic residues has the potential to identify novel c
141 us, despite possessing all of the putatively catalytic residues, has no detectable RNA cleavage activ
142 ite-directed single mutants of BphD in which catalytic residues His-265 and Ser-112 were replaced wit
143 HNH catalytic domain contains the conserved catalytic residues His-Asn-His and a zinc-binding site [
144 del also illuminated the three putative RebM catalytic residues (His140/141 and Asp166) subsequently
146 prompted us to elucidate the role of the new catalytic residue (His33) in the active site of spDHFR.
147 ticipation in a salt bridge network with two catalytic residues identified previously: Arg38, which b
148 % at a corresponding recall (the fraction of catalytic residues identified) of 57% on a standard benc
149 phenylalanine, indicating that the acid-base catalytic residue, identified in other AKRs, has a conse
151 l measurement of a pKa near neutrality for a catalytic residue in a ribozyme and show that ribozymes,
152 e features, such as Ser replacing Thr as the catalytic residue in certain BPH subfamilies, suggest a
153 tionally, we identified Glu-176, a conserved catalytic residue in GH16 endo-beta-1,3-glucanases, as e
154 the polypeptide chain and mutation of a key catalytic residue in one of the duplicated segments.
157 e to multiple disease models, we mutated the catalytic residue in the JHM strain of MHV (JHMV), which
159 e activity in vitro, and point mutation of a catalytic residue in this domain disrupted the deadenyla
160 heterozygous mutation, affecting a critical catalytic residue in TREX1, that results in typical Aica
161 port pervasive conservation gradients toward catalytic residues in a dataset of 524 distinct enzymes:
165 rg-73, and Glu-114, previously identified as catalytic residues in Cg10062, have also been implicated
166 rotein, such as sites in the protein core or catalytic residues in enzymes, are evolutionarily more c
172 arison of the shifts in the positions of the catalytic residues in the inhibitor complex presented he
173 ases lack conservation of one or more of the catalytic residues in the kinase core and as a consequen
177 ion, eliminating one of the highly conserved catalytic residues in this class of endonucleases, drama
179 GTP hydrolysis, the TBC domain supplies two catalytic residues in trans, an arginine finger analogou
181 ed with a set of hydrophilic and potentially catalytic residues, including essential aspartic acids.
182 y the presence of equivalently placed acidic catalytic residues, including one at the end of the firs
183 how that functional sites, and in particular catalytic residues, induce long-range evolutionary const
184 bstrate-induced conformational changes bring catalytic residues into alignment, alter the local envir
185 hitotriose, to identify Asp75 as the primary catalytic residue involved in this cleavage, and to solv
186 and Tyr-410, were proposed as candidates for catalytic residues involved in deprotonation of the meth
187 ted, so that it includes the function of the catalytic residues involved in the reaction and the chem
188 ated so that it includes the function of the catalytic residues involved in the reaction and the mech
191 However, experimental identification of catalytic residues is a tedious and time-consuming task,
193 Moreover, the relative orientation of these catalytic residues is similar to that observed in the an
195 to tolerate a mutation of its most conserved catalytic residue (its histidine general base), and the
200 ntification and characterization of possible catalytic residues, Lys184, which is responsible for for
203 ive point mutation was introduced at the key catalytic residue, mutant DNMT1 failed to rescue any of
207 K, a naturally occurring variation at the NA catalytic residue of A(H7N9) viruses, conferred reduced
210 ro(427), Gly(428), and Gly(429) activate the catalytic residue of the enzyme, Thr(352), and stabilize
211 topology, which was carried out to locate a catalytic residue of the protein, showed that modificati
213 Cys-195 mutant of thrombin revealed that the catalytic residue of thrombin is modulated by Na(+), but
214 lyses in ago mutant plants revealed that the catalytic residues of AGO1, AGO2, and AGO7 are required
215 of the interplay between the regulatory and catalytic residues of c-Met, and by comparison between t
216 lix of FliM(M) (alpha1) does not contain the catalytic residues of CheC and CheX but does include pos
218 By making inactivating mutations to the catalytic residues of human Hyal2, we found that hyaluro
219 Molecular modeling demonstrated that the catalytic residues of mNsp15 are superimposable with its
220 show that mutation of each of the five RNase catalytic residues of PICV NP diminishes the IFN suppres
221 be a novel sensitive method to identify both catalytic residues of retaining beta-glucosidases by the
224 ects were relieved by either mutation of the catalytic residues of the SAMHD1 phosphohydrolase domain
227 sents an approximately 14-fold enrichment of catalytic residues on the entire input set (correspondin
229 stability, lowering the pKa of proton donor catalytic residue, optimized spatial distribution of the
230 ntial chemical properties of the first-shell catalytic residues, particularly their spatial arrangeme
231 Protein binding site residues, especially catalytic residues, play a central role in protein funct
233 periments show that Discern's improvement in catalytic residue prediction is derived from the combina
234 n shown to boost the recall and precision of catalytic residue prediction over other sequence-based m
236 residue-level scores derived from well-known catalytic residue predictors can improve prediction accu
239 lly-competent conformation and pre-organizes catalytic residue Q61; mutations disturb the R789/Q61 or
240 inant viruses with mutant NA-encoding genes (catalytic residues R152K and R292K, framework residues E
241 f the scissile phosphate and coordination of catalytic residues relative to each other so that DNA cl
243 isC has provided the first insights into the catalytic residues responsible for the cyclization step
248 s dependent on the presence of the predicted catalytic residue Ser141 and was inhibited by the lipase
252 Alanine-scanning mutagenesis of predicted catalytic residues showed the predicted loss of in vitro
254 ite a domain architecture and positioning of catalytic residues similar to those of other family 39 g
255 se activity and suggests Y181 as a potential catalytic residue similarly to His-hydrophobe-His relaxa
257 A highly purified wild-type CPAF but not a catalytic residue-substituted mutant CPAF was sufficient
259 f 7.7 is measured for the amine group of the catalytic residue T1, confirming that it can act as a pr
260 so revealed tightly bound chlorides near the catalytic residue that may contribute to catalytic activ
261 hieve a precision (the fraction of predicted catalytic residues that are catalytic) of 18.5% at a cor
262 on of the active site and positioning of the catalytic residues that are consistent with an inverting
263 arily distinct enzymes characterize key APE1 catalytic residues that are potentially functionally sim
264 Structure-guided mutagenesis revealed four catalytic residues that enabled the re-programming of Sd
265 similar positioning of donor, acceptor, and catalytic residues that provide a common structural fram
266 cted mutagenesis of PxaTPS8 revealed several catalytic residues that, together with quantum chemical
267 the SeV L protein invariant lysine 1782 as a catalytic residue, the recombinant virus with a single K
268 tivity is ensured by the absence of critical catalytic residues, the filling of the substrate groove,
273 as designed to affect the reactivity of that catalytic residue to allow for capture of the preacylati
275 ciative fashion, Tth UDGb relies on multiple catalytic residues to facilitate its excision of hypoxan
276 topoisomerase III where DNA binding realigns catalytic residues to form a functional active site.
277 ubstrate-binding energy to actively misalign catalytic residues to reduce the rate of misincorporatio
278 bstrate-binding residues (as well as one key catalytic residue) to expand the substrate range provide
281 finasteride accepts hydrogen bonds from the catalytic residues Tyr-58 and Glu-120 in the active site
282 istance between the substrate and both a key catalytic residue (Tyr157) and the enzyme-bound NAD+ cof
283 ism of entropy compensation for ordering the catalytic residues upon ligand binding by disordering sp
284 conserved Type IA core domains and the same catalytic residue used in DNA topoisomerase reaction; ho
285 t of catalytic residues which act upon other catalytic residues, using a set of 60 enzyme structures.
286 utating both intermolecular dimerization and catalytic residues was CPAF activation completely blocke
288 ed their substrate preference, whereas their catalytic residues were identified using site-directed m
289 se of other arteriviruses, and the predicted catalytic residues were shown to be proximal by homology
290 We have also assembled a separate dataset of catalytic residues which act upon other catalytic residu
291 provide limits on "expected geometries" for catalytic residues, which will help to identify these re
292 tatistics describing the typical geometry of catalytic residues with regard to the substrate and one
293 regulatory mechanism, in which engagement of catalytic residues with the substrate is coupled to corr
295 ation (D269A) that alters a highly conserved catalytic residue within the T7 loop completely eliminat
297 monstrates the relationship of substrate and catalytic residues within the active site, confirming ea
299 the same dataset CSmetaPred_poc predicts all catalytic residues within top 20 ranks for 73% of enzym
300 st that, in addition to the highly conserved catalytic residues, YopJ family effectors also require c
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