PDB: 974 件ウェブページステータス検索Chemie searchBIRD

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6D7I	CTX-M-14 Apoenzyme D233N Point Mutant 分子名称: Beta-lactamase 著者 Kemp, M, Nichols, D, Chen, Y. 登録日 2018-04-24 公開日 2019-07-24 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.001 Å) 主引用文献 The Role of Asp-Asp Short Hydrogen Bond in Maintaining Active Site Integrity of CTX-M Beta-Lactamase To be Published
6D7H	CTX-M-14 Apoenzyme 分子名称: Beta-lactamase, PHOSPHATE ION, POTASSIUM ION 著者 Kemp, M, Nichols, D, Chen, Y. 登録日 2018-04-24 公開日 2019-07-24 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.801 Å) 主引用文献 The Role of Asp-Asp Short Hydrogen Bond in Maintaining Active Site Integrity of CTX-M Beta-Lactamase To be Published
6DMH	A multiconformer ligand model of acylenzyme intermediate of meropenem bound to an SFC-1 E166A mutant 分子名称: (4R,5S)-3-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-5-[(2S,3R)-3-hydroxy-1-oxobutan-2-yl]-4-methyl-4,5-d ihydro-1H-pyrrole-2-carboxylic acid, 1,2-ETHANEDIOL, Beta-lactamase 著者 Hudson, B.M, van Zundert, G, Keedy, D.A, Fonseca, R, Heliou, A, Suresh, P, Borrelli, K, Day, T, Fraser, J.S, van den Bedem, H. 登録日 2018-06-05 公開日 2018-12-19 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (1.3 Å) 主引用文献 qFit-ligand Reveals Widespread Conformational Heterogeneity of Drug-Like Molecules in X-Ray Electron Density Maps. J. Med. Chem., 61, 2018
6CYK	CTX-M-14 N106S mutant 分子名称: ACETATE ION, Beta-lactamase 著者 Patel, M.P, Hu, L, Sankaran, B, Brown, C, Prasad, B.V.V, Palzkill, T. 登録日 2018-04-06 公開日 2018-10-10 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Synergistic effects of functionally distinct substitutions in beta-lactamase variants shed light on the evolution of bacterial drug resistance. J. Biol. Chem., 293, 2018
6DGU	PER-2 class A extended-spectrum beta-lactamase crystal structure at 2.69 Angstrom resolution 分子名称: Beta-lactamase 著者 Power, P, Ruggiero, M, Gutkind, G, Bonomo, R, Klinke, S. 登録日 2018-05-18 公開日 2019-05-22 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.691 Å) 主引用文献 Structural Insights into the Inhibition of the Extended-Spectrum beta-Lactamase PER-2 by Avibactam. Antimicrob.Agents Chemother., 63, 2019
2CC1	Crystal structure of the class A beta-lactamase from Mycobacterium fortuitum 分子名称: Beta-lactamase 著者 Sauvage, E, Fonze, E, Charlier, P. 登録日 2006-01-11 公開日 2006-01-13 最終更新日 2023-12-13 実験手法 X-RAY DIFFRACTION (2.13 Å) 主引用文献 Crystal structure of the Mycobacterium fortuitum class A beta-lactamase: structural basis for broad substrate specificity. Antimicrob. Agents Chemother., 50, 2006
6C79	Conformational Changes in a Class A Beta lactamase that Prime it for Catalysis 分子名称: (6R,7R)-3-(acetyloxymethyl)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-8-oxo-5-thia-1-azabicy clo[4.2.0]oct-2-ene-2-carboxylic acid, Beta-lactamase Toho-1, SULFATE ION 著者 Coates, L, Langan, P.S, Vandavasi, V.G, Cooper, S.J, Weiss, K.L, Ginell, S.L, Parks, J.M. 登録日 2018-01-22 公開日 2018-03-21 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (1.1 Å) 主引用文献 Substrate Binding Induces Conformational Changes in a Class A Beta-lactamase That Prime It for Catalysis Acs Catalysis, 8, 2018
2G2W	Crystal Structure of the SHV D104K Beta-lactamase/Beta-lactamase inhibitor protein (BLIP) complex 分子名称: Beta-lactamase SHV-1, Beta-lactamase inhibitory protein 著者 Reynolds, K.A, Thomson, J.M, Corbett, K.D, Bethel, C.R, Berger, J.M, Kirsch, J.F, Bonomo, R.A, Handel, T.M. 登録日 2006-02-16 公開日 2006-07-04 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Structural and Computational Characterization of the SHV-1 beta-Lactamase-beta-Lactamase Inhibitor Protein Interface. J.Biol.Chem., 281, 2006
2GDN	Crystal structure of the Mycobacterium tuberculosis beta-lactamase 分子名称: Beta-lactamase 著者 Wang, F, Cassidy, C, Sacchettini, J.C, TB Structural Genomics Consortium (TBSGC) 登録日 2006-03-16 公開日 2006-04-18 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (1.72 Å) 主引用文献 Crystal Structure and Activity Studies of the Mycobacterium tuberculosis {beta}-Lactamase Reveal Its Critical Role in Resistance to {beta}-Lactam Antibiotics. Antimicrob.Agents Chemother., 50, 2006
2G2U	Crystal Structure of the SHV-1 Beta-lactamase/Beta-lactamase inhibitor protein (BLIP) complex 分子名称: Beta-lactamase SHV-1, Beta-lactamase inhibitory protein 著者 Reynolds, K.A, Thomson, J.M, Corbett, K.D, Bethel, C.R, Berger, J.M, Kirsch, J.F, Bonomo, R.A, Handel, T.M. 登録日 2006-02-16 公開日 2006-07-04 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Structural and Computational Characterization of the SHV-1 beta-Lactamase-beta-Lactamase Inhibitor Protein Interface. J.Biol.Chem., 281, 2006
6DZ8	Crystal structure of S. aureus penicillin binding protein 4 (PBP4) mutant (S75C) 分子名称: Penicillin-binding protein 4, ZINC ION 著者 Alexander, J.A.N, Strynadka, N.C.J. 登録日 2018-07-03 公開日 2018-12-19 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.86 Å) 主引用文献 Recognition of Peptidoglycan Fragments by the Transpeptidase PBP4 FromStaphylococcus aureus. Front Microbiol, 9, 2018
2H0T	Crystal structure of the M69V E166A double mutant of SHV-1 b-lactamase complexed to clavulanic acid 分子名称: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, Broad-spectrum beta-lactamase SHV-1, CYCLOHEXYL-HEXYL-BETA-D-MALTOSIDE, ... 著者 van den Akker, F, Padayatti, P.S. 登録日 2006-05-15 公開日 2007-01-30 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Effect of the inhibitor-resistant M69V substitution on the structures and populations of trans-enamine beta-lactamase intermediates. Biochemistry, 45, 2006
2H10	Crystal structure of the M69V E166A double mutant of SHV-1 b-lactamase complexed to tazobactam 分子名称: Beta-lactamase SHV-1, CYCLOHEXYL-HEXYL-BETA-D-MALTOSIDE, TAZOBACTAM INTERMEDIATE 著者 van den Akker, F, Padayatti, P.S. 登録日 2006-05-15 公開日 2007-01-30 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (1.75 Å) 主引用文献 Effect of the inhibitor-resistant M69V substitution on the structures and populations of trans-enamine beta-lactamase intermediates. Biochemistry, 45, 2006
2H0Y	Crystal structure of the M69V E166A double mutant of SHV-1 b-lactamase complexed to sulbactam 分子名称: Beta-lactamase SHV-1, CYCLOHEXYL-HEXYL-BETA-D-MALTOSIDE, ETHANESULFONIC ACID, ... 著者 van den Akker, F, Padayatti, P.S. 登録日 2006-05-15 公開日 2007-01-30 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Effect of the inhibitor-resistant M69V substitution on the structures and populations of trans-enamine beta-lactamase intermediates. Biochemistry, 45, 2006
2H5S	SA2-13 penam sulfone complexed to wt SHV-1 beta-lactamase 分子名称: (3R)-4-[(4-CARBOXYBUTANOYL)OXY]-N-[(1E)-3-OXOPROP-1-EN-1-YL]-3-SULFINO-D-VALINE, CYCLOHEXYL-HEXYL-BETA-D-MALTOSIDE, SHV-1 beta-lactamase 著者 van den Akker, F, Padayatti, P.S. 登録日 2006-05-27 公開日 2006-10-17 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (1.28 Å) 主引用文献 Rational Design of a beta-Lactamase Inhibitor Achieved via Stabilization of the trans-Enamine Intermediate: 1.28 A Crystal Structure of wt SHV-1 Complex with a Penam Sulfone. J.Am.Chem.Soc., 128, 2006
3NI9	GES-2 carbapenemase apo form 分子名称: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, Beta-lactamase GES-2 著者 Frase, H, Smith, C.A, Toth, M, Vakulenko, S.B. 登録日 2010-06-15 公開日 2011-02-23 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Kinetic and structural requirements for carbapenemase activity in GES-type beta-lactamases. Biochemistry, 54, 2015
3NC8	Crystal Structure of BlaC-E166A covalently bound with Mecillinam 分子名称: 2-[(1R)-1-{[(E)-azepan-1-ylmethylidene]amino}-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, Beta-lactamase, PHOSPHATE ION 著者 Tremblay, L.W, Blanchard, J.S. 登録日 2010-06-04 公開日 2011-12-14 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 BlaC-E166A covalently bound with cephalosporins and penicillins To be Published
3OPH	ESBL R164S mutant of SHV-1 beta-lactamase 分子名称: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, Beta-lactamase SHV-1, CYCLOHEXYL-HEXYL-BETA-D-MALTOSIDE 著者 Sampson, J.M, van den Akker, F. 登録日 2010-09-01 公開日 2011-07-13 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (1.34 Å) 主引用文献 Ligand-dependent disorder of the Omega loop observed in extended-spectrum SHV-type beta-lactamase. Antimicrob.Agents Chemother., 55, 2011
3OPL	ESBL R164H mutant SHV-1 beta-lactamase 分子名称: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, Beta-lactamase SHV-1, CYCLOHEXYL-HEXYL-BETA-D-MALTOSIDE 著者 Sampson, J.M, van den Akker, F. 登録日 2010-09-01 公開日 2011-07-13 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Ligand-dependent disorder of the Omega loop observed in extended-spectrum SHV-type beta-lactamase. Antimicrob.Agents Chemother., 55, 2011
3OPR	ESBL R164H mutant of SHV-1 beta-lactamase complexed to SA2-13 分子名称: (3R)-4-[(4-CARBOXYBUTANOYL)OXY]-N-[(1E)-3-OXOPROP-1-EN-1-YL]-3-SULFINO-D-VALINE, Beta-lactamase SHV-1, CYCLOHEXYL-HEXYL-BETA-D-MALTOSIDE 著者 Sampson, J.M, van den Akker, F. 登録日 2010-09-01 公開日 2011-07-13 最終更新日 2017-11-22 実験手法 X-RAY DIFFRACTION (1.65 Å) 主引用文献 Ligand-dependent disorder of the Omega loop observed in extended-spectrum SHV-type beta-lactamase. Antimicrob.Agents Chemother., 55, 2011
3P98	The crystal structure of the extended spectrum beta-lactamase TEM-72 reveals inhibition by citrate 分子名称: Beta-lactamase TEM-72, CITRIC ACID, DI(HYDROXYETHYL)ETHER 著者 Docquier, J.D, Benvenuti, M, Calderone, V, Rossolini, G.M, Mangani, S. 登録日 2010-10-16 公開日 2011-03-09 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Structure of the extended-spectrum [beta]-lactamase TEM-72 inhibited by citrate Acta Crystallogr.,Sect.F, 67, 2011
3N8L	Crystal Structure of BlaC-E166A covalently bound with Ampicillin 分子名称: (2R,4S)-2-[(1R)-1-{[(2R)-2-amino-2-phenylacetyl]amino}-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, Beta-lactamase, PHOSPHATE ION 著者 Tremblay, L.W, Blanchard, J.S. 登録日 2010-05-28 公開日 2011-12-14 最終更新日 2017-11-08 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Structures of BlaC-E166A covalently bound to beta-lactams from all classes. To be Published
3N7W	Crystal Structure of BlaC-E166A covalently bound with Amoxicillin 分子名称: 2-{1-[2-AMINO-2-(4-HYDROXY-PHENYL)-ACETYLAMINO]-2-OXO-ETHYL}-5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID, Beta-lactamase, PHOSPHATE ION 著者 Tremblay, L.W, Blanchard, J.S. 登録日 2010-05-27 公開日 2011-12-14 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 BlaC-E166A Bound with btea-lactams of all classes To be Published
3NDE	Crystal Structure of BlaC-E166A covalently bound with Cephalotin 分子名称: (2R)-5-[(acetyloxy)methyl]-2-{(1R)-2-oxo-1-[(thiophen-2-ylacetyl)amino]ethyl}-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid, Beta-lactamase, PHOSPHATE ION 著者 Tremblay, L.W, Blanchard, J.S. 登録日 2010-06-07 公開日 2011-12-14 最終更新日 2017-11-08 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 BlaC-E166A covalently bound with cephalosporins and penicillins To be Published
3NCK	Crystal Structure of BlaC-E166A covalently bound with Nafcillin 分子名称: (2R,4S)-2-[(1R)-1-{[(2-ethoxynaphthalen-1-yl)carbonyl]amino}-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, Beta-lactamase 著者 Tremblay, L.W, Blanchard, J.S. 登録日 2010-06-04 公開日 2011-12-14 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (2.8 Å) 主引用文献 BlaC-E166A covalently bound with cephalosporins and penicillins To be Published

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