Author results

4O8H
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0.85A RESOLUTION STRUCTURE OF PEG 400 BOUND CYCLOPHILIN D
Descriptor:Peptidyl-prolyl cis-trans isomerase F, mitochondrial, DI(HYDROXYETHYL)ETHER, ...
Authors:Lovell, S., Valasani, K.R., Battaile, K.P., Wang, C., Yan, S.S.
Deposit date:2013-12-27
Release date:2014-06-11
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (0.85 Å)
Cite:High-resolution crystal structures of two crystal forms of human cyclophilin D in complex with PEG 400 molecules.
Acta Crystallogr F Struct Biol Commun, 70, 2014
3DHA
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AN ULTRAL HIGH RESOLUTION STRUCTURE OF N-ACYL HOMOSERINE LACTONE HYDROLASE WITH THE PRODUCT N-HEXANOYL-L-HOMOSERINE BOUND AT AN ALTERNATIVE SITE
Descriptor:N-Acyl Homoserine Lactone Hydrolase, ZINC ION, N-hexanoyl-L-homoserine, ...
Authors:Liu, D., Momb, J., Thomas, P.W., Moulin, A., Petsko, G.A., Fast, W., Ringe, D.
Deposit date:2008-06-17
Release date:2008-07-29
Last modified:2017-10-25
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Mechanism of the quorum-quenching lactonase (AiiA) from Bacillus thuringiensis. 1. Product-bound structures.
Biochemistry, 47, 2008
5ZGW
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CRYSTAL STRUCTURE OF NDM-1 AT PH7.5 WITH 1 MOLECULE PER ASYMMETRIC UNIT (CRYSTALLIZED AT SUCCINATE PH5.5 AND SOAKED AT SUCCINATE PH7.5)
Descriptor:Metallo-beta-lactamase type 2, ZINC ION, HYDROXIDE ION, ...
Authors:Zhang, H., Hao, Q.
Deposit date:2018-03-10
Release date:2018-08-22
Last modified:2018-12-12
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Active-Site Conformational Fluctuations Promote the Enzymatic Activity of NDM-1.
Antimicrob. Agents Chemother., 62, 2018
5ZGX
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CRYSTAL STRUCTURE OF NDM-1 AT PH7.5 (SUCCINATE) WITH 1 MOLECULE PER ASYMMETRIC UNIT
Descriptor:Metallo-beta-lactamase type 2, ZINC ION, 1,2-ETHANEDIOL, ...
Authors:Zhang, H., Hao, Q.
Deposit date:2018-03-10
Release date:2018-08-22
Last modified:2018-12-12
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Active-Site Conformational Fluctuations Promote the Enzymatic Activity of NDM-1.
Antimicrob. Agents Chemother., 62, 2018
5ZGY
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CRYSTAL STRUCTURE OF NDM-1 AT PH7.5 (BIS-TRIS) WITH 1 MOLECULE PER ASYMMETRIC UNIT
Descriptor:Metallo-beta-lactamase type 2, ZINC ION, HYDROXIDE ION, ...
Authors:Zhang, H., Hao, Q.
Deposit date:2018-03-10
Release date:2018-08-22
Last modified:2018-12-12
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Active-Site Conformational Fluctuations Promote the Enzymatic Activity of NDM-1.
Antimicrob. Agents Chemother., 62, 2018
5ZGZ
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CRYSTAL STRUCTURE OF NDM-1 AT PH7.5 (IMIDAZOLE) WITH 1 MOLECULE PER ASYMMETRIC UNIT
Descriptor:Metallo-beta-lactamase type 2, ZINC ION, HYDROXIDE ION, ...
Authors:Zhang, H., Hao, Q.
Deposit date:2018-03-10
Release date:2018-08-22
Last modified:2018-12-12
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Active-Site Conformational Fluctuations Promote the Enzymatic Activity of NDM-1.
Antimicrob. Agents Chemother., 62, 2018
5ZGI
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CRYSTAL STRUCTURE OF NDM-1 AT PH6.5 (SUCCINATE) WITH 1 MOLECULE PER ASYMMETRIC UNIT
Descriptor:Metallo-beta-lactamase type 2, ZINC ION, HYDROXIDE ION, ...
Authors:Zhang, H., Hao, Q.
Deposit date:2018-03-09
Release date:2018-08-22
Last modified:2018-12-12
Method:X-RAY DIFFRACTION (0.98 Å)
Cite:Active-Site Conformational Fluctuations Promote the Enzymatic Activity of NDM-1.
Antimicrob. Agents Chemother., 62, 2018
4LN2
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THE SECOND SH3 DOMAIN FROM CAP/PONSIN IN COMPLEX WITH PROLINE RICH PEPTIDE FROM VINCULIN
Descriptor:Sorbin and SH3 domain-containing protein 1, proline rich peptide
Authors:Zhao, D., Li, F., Wu, J., Shi, Y., Zhang, Z., Gong, Q.
Deposit date:2013-07-11
Release date:2014-05-28
Last modified:2014-12-10
Method:X-RAY DIFFRACTION (1 Å)
Cite:Structural investigation of the interaction between the tandem SH3 domains of c-Cbl-associated protein and vinculin
J.Struct.Biol., 187, 2014
5ZGE
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CRYSTAL STRUCTURE OF NDM-1 AT PH5.5 (BIS-TRIS) IN COMPLEX WITH HYDROLYZED AMPICILLIN
Descriptor:Metallo-beta-lactamase type 2, (2R,4S)-2-[(R)-{[(2R)-2-amino-2-phenylacetyl]amino}(carboxy)methyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, ZINC ION, ...
Authors:Zhang, H., Hao, Q.
Deposit date:2018-03-08
Release date:2018-08-22
Last modified:2018-12-12
Method:X-RAY DIFFRACTION (1 Å)
Cite:Active-Site Conformational Fluctuations Promote the Enzymatic Activity of NDM-1.
Antimicrob. Agents Chemother., 62, 2018
5ZH1
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CRYSTAL STRUCTURE OF NDM-1 AT PH7.5 (IMIDAZOLE) WITH 2 MOLECULES PER ASYMMETRIC UNIT
Descriptor:Metallo-beta-lactamase type 2, ZINC ION, HYDROXIDE ION, ...
Authors:Zhang, H., Hao, Q.
Deposit date:2018-03-10
Release date:2018-08-22
Last modified:2018-12-12
Method:X-RAY DIFFRACTION (1.05 Å)
Cite:Active-Site Conformational Fluctuations Promote the Enzymatic Activity of NDM-1.
Antimicrob. Agents Chemother., 62, 2018
4RBX
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CRYSTAL STRUCTURE OF HUMAN ALPHA-DEFENSIN 5, HD5 (GLU21ARG MUTANT)
Descriptor:Defensin-5, SULFATE ION
Authors:Pazgier, M., Gohain, N., Tolbert, W.D.
Deposit date:2014-09-13
Release date:2015-07-29
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:Design of a potent antibiotic peptide based on the active region of human defensin 5.
J.Med.Chem., 58, 2015
4H07
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COMPLEX OF G65T MYOGLOBIN WITH PHENOL IN ITS PROXIMAL CAVITY
Descriptor:Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, PHENOL, ...
Authors:Lebioda, L., Lovelace, L.L., Celeste, L.R., Huang, X., Wang, C., Shengfang, S., Dawson, J.H.
Deposit date:2012-09-07
Release date:2012-11-21
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (1.14 Å)
Cite:Complex of myoglobin with phenol bound in a proximal cavity.
Acta Crystallogr.,Sect.F, 68, 2012
5ZGP
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CRYSTAL STRUCTURE OF NDM-1 AT PH6.2 (BIS-TRIS) IN COMPLEX WITH HYDROLYZED AMPICILLIN
Descriptor:Metallo-beta-lactamase type 2, ZINC ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Zhang, H., Hao, Q.
Deposit date:2018-03-10
Release date:2018-08-22
Last modified:2018-12-12
Method:X-RAY DIFFRACTION (1.15 Å)
Cite:Active-Site Conformational Fluctuations Promote the Enzymatic Activity of NDM-1.
Antimicrob. Agents Chemother., 62, 2018
5ZGR
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CRYSTAL STRUCTURE OF NDM-1 AT PH7.3 (HEPES) IN COMPLEX WITH HYDROLYZED AMPICILLIN
Descriptor:Metallo-beta-lactamase type 2, ZINC ION, (2R,4S)-2-[(R)-{[(2R)-2-amino-2-phenylacetyl]amino}(carboxy)methyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, ...
Authors:Zhang, H., Hao, Q.
Deposit date:2018-03-10
Release date:2018-08-22
Last modified:2018-12-12
Method:X-RAY DIFFRACTION (1.15 Å)
Cite:Active-Site Conformational Fluctuations Promote the Enzymatic Activity of NDM-1.
Antimicrob. Agents Chemother., 62, 2018
5ZGV
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CRYSTAL STRUCTURE OF NDM-1 AT PH8.0 (TRIS) WITH 2 MOLECULES PER ASYMMETRIC UNIT
Descriptor:Metallo-beta-lactamase type 2, ZINC ION, HYDROXIDE ION, ...
Authors:Zhang, H., Hao, Q.
Deposit date:2018-03-10
Release date:2018-08-22
Last modified:2018-12-12
Method:X-RAY DIFFRACTION (1.15 Å)
Cite:Active-Site Conformational Fluctuations Promote the Enzymatic Activity of NDM-1.
Antimicrob. Agents Chemother., 62, 2018
4EZF
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THE CRYSTAL STRUCTURE OF A HUMAN MITONEET MUTANT WITH AN ALA INSERTED BETWEEN ASP 67 AND LYS 68
Descriptor:CDGSH iron-sulfur domain-containing protein 1, FE2/S2 (INORGANIC) CLUSTER
Authors:Baxter, E.L., Zuris, J.A., Wang, C., Axelrod, H.L., Cohen, A.E., Paddock, M.L., Nechushtai, R., Onuchic, J.N., Jennings, P.A.
Deposit date:2012-05-02
Release date:2012-12-26
Last modified:2013-01-30
Method:X-RAY DIFFRACTION (1.19 Å)
Cite:Allosteric control in a metalloprotein dramatically alters function.
Proc.Natl.Acad.Sci.USA, 110, 2013
4MC9
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HIV PROTEASE IN COMPLEX WITH AA74
Descriptor:Protease, (3S)-tetrahydrofuran-3-yl {(2S,3R)-4-[(4R)-7-fluoro-1,1-dioxido-4-(propan-2-yl)-4,5-dihydro-1,2-benzothiazepin-2(3H)-yl]-3-hydroxy-1-phenylbutan-2-yl}carbamate, 1,2-ETHANEDIOL, ...
Authors:Ganguly, A.K., Alluri, S.S., Wang, C., Antropow, A., White, A., Caroccia, D., Biswas, D., Kang, E., Zhang, L., Carroll, S.S., Burlein, C., Munshi, V., Orth, P., Strickland, C.
Deposit date:2013-08-21
Release date:2014-04-02
Method:X-RAY DIFFRACTION (1.19 Å)
Cite:Structural Optimization of Cyclic Sulfonamide based Novel HIV-1 Protease Inhibitors to Pico Molar Affinities guided by X-ray Crystallographic Analysis
Tetrahedron, 2014
5SZC
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STRUCTURE OF HUMAN DPF3 DOUBLE-PHD DOMAIN BOUND TO HISTONE H3 TAIL PEPTIDE WITH MONOMETHYLATED K4 AND ACETYLATED K14
Descriptor:Zinc finger protein DPF3, Histone H3 tail peptide, ZINC ION, ...
Authors:Singh, N., Local, A., Shiau, A., Ren, B., Corbett, K.D.
Deposit date:2016-08-13
Release date:2017-08-16
Last modified:2019-02-27
Method:X-RAY DIFFRACTION (1.193 Å)
Cite:Identification of H3K4me1-associated proteins at mammalian enhancers.
Nat. Genet., 50, 2018
5SZB
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STRUCTURE OF HUMAN DPF3 DOUBLE-PHD DOMAIN BOUND TO HISTONE H3 TAIL PEPTIDE WITH ACETYLATED K14
Descriptor:Zinc finger protein DPF3, Histone H3 tail peptide, ZINC ION, ...
Authors:Singh, N., Local, A., Shiau, A., Ren, B., Corbett, K.D.
Deposit date:2016-08-13
Release date:2017-08-16
Last modified:2019-02-27
Method:X-RAY DIFFRACTION (1.2 Å)
Cite:Identification of H3K4me1-associated proteins at mammalian enhancers.
Nat. Genet., 50, 2018
5WQJ
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CRYSTAL STRUCTURE OF 3-MERCAPTOPYRUVATE SULFURTRANSFERASE(3MST) IN COMPLEX WITH COMPOUND1
Descriptor:Sulfurtransferase, 2-[2-[(4-oxidanylidene-3~{H}-quinazolin-2-yl)sulfanyl]ethanoylamino]thiophene-3-carboxamide, SODIUM ION
Authors:Suwanai, Y., Toma-Fukai, S., Shimizu, T.
Deposit date:2016-11-27
Release date:2017-09-06
Method:X-RAY DIFFRACTION (1.2 Å)
Cite:Discovery and Mechanistic Characterization of Selective Inhibitors of H2S-producing Enzyme: 3-Mercaptopyruvate Sulfurtransferase (3MST) Targeting Active-site Cysteine Persulfide
Sci Rep, 7, 2017
5ZGF
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CRYSTAL STRUCTURE OF NDM-1 Q123G MUTANT
Descriptor:Metallo-beta-lactamase type 2, ZINC ION, HYDROXIDE ION
Authors:Zhang, H., Hao, Q.
Deposit date:2018-03-08
Release date:2018-08-22
Last modified:2018-12-12
Method:X-RAY DIFFRACTION (1.2 Å)
Cite:Active-Site Conformational Fluctuations Promote the Enzymatic Activity of NDM-1.
Antimicrob. Agents Chemother., 62, 2018
5ZGT
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CRYSTAL STRUCTURE OF NDM-1 AT PH7.5 (HEPES) WITH 2 MOLECULES PER ASYMMETRIC UNIT
Descriptor:Metallo-beta-lactamase type 2, ZINC ION, HYDROXIDE ION, ...
Authors:Zhang, H., Hao, Q.
Deposit date:2018-03-10
Release date:2018-08-22
Last modified:2018-12-12
Method:X-RAY DIFFRACTION (1.2 Å)
Cite:Active-Site Conformational Fluctuations Promote the Enzymatic Activity of NDM-1.
Antimicrob. Agents Chemother., 62, 2018
3U3E
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COMPLEX OF WILD TYPE MYOGLOBIN WITH PHENOL IN ITS PROXIMAL CAVITY
Descriptor:Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, PHENOL, ...
Authors:Celeste, L.R., Lebioda, L.
Deposit date:2011-10-05
Release date:2012-11-28
Last modified:2012-12-12
Method:X-RAY DIFFRACTION (1.21 Å)
Cite:Complex of myoglobin with phenol bound in a proximal cavity.
Acta Crystallogr.,Sect.F, 68, 2012
4OOD
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STRUCTURE OF K42Y MUTANT OF SPERM WHALE MYOGLOBIN
Descriptor:Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, SULFATE ION, ...
Authors:Lebioda, L., Wang, C., Lovelace, L.L.
Deposit date:2014-01-31
Release date:2014-11-26
Method:X-RAY DIFFRACTION (1.24 Å)
Cite:Structures of K42N and K42Y sperm whale myoglobins point to an inhibitory role of distal water in peroxidase activity.
Acta Crystallogr.,Sect.D, 70, 2014
4OF9
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STRUCTURE OF K42N VARIANT OF SPERM WHALE MYOGLOBIN
Descriptor:Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, SULFATE ION, ...
Authors:Lebioda, L., Wang, C., Lovelace, L.L.
Deposit date:2014-01-14
Release date:2014-11-26
Method:X-RAY DIFFRACTION (1.241 Å)
Cite:Structures of K42N and K42Y sperm whale myoglobins point to an inhibitory role of distal water in peroxidase activity.
Acta Crystallogr.,Sect.D, 70, 2014