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4EQX
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BU of 4eqx by Molmil
Crystal Structure of the C43S Mutant of Staphylococcus aureus CoADR
Descriptor: CHLORIDE ION, Coenzyme A disulfide reductase, FLAVIN-ADENINE DINUCLEOTIDE, ...
Authors:Edwards, J.S, Wallace, B.D, Wallen, J.R, Claiborne, A, Redinbo, M.R.
Deposit date:2012-04-19
Release date:2012-10-17
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Turnover-Dependent Covalent Inactivation of Staphylococcus aureus Coenzyme A-Disulfide Reductase by Coenzyme A-Mimetics: Mechanistic and Structural Insights.
Biochemistry, 51, 2012
4EQR
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BU of 4eqr by Molmil
Crystal structure of the Y361F mutant of Staphylococcus aureus CoADR
Descriptor: CHLORIDE ION, COENZYME A, Coenzyme A disulfide reductase, ...
Authors:Wallace, B.D, Edwards, J.S, Wallen, J.R, Claiborne, A, Redinbo, M.R.
Deposit date:2012-04-19
Release date:2012-10-17
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Turnover-Dependent Covalent Inactivation of Staphylococcus aureus Coenzyme A-Disulfide Reductase by Coenzyme A-Mimetics: Mechanistic and Structural Insights.
Biochemistry, 51, 2012
4EMW
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BU of 4emw by Molmil
Crystal Structure of Staphylococcus aureus bound with the covalent inhibitor EtVC-CoA
Descriptor: CHLORIDE ION, Coenzyme A disulfide reductase, FLAVIN-ADENINE DINUCLEOTIDE, ...
Authors:Edwards, J.S, Wallace, B.D, Claiborne, A, Redinbo, M.R.
Deposit date:2012-04-12
Release date:2012-10-17
Last modified:2019-07-17
Method:X-RAY DIFFRACTION (2.39 Å)
Cite:Turnover-Dependent Covalent Inactivation of Staphylococcus aureus Coenzyme A-Disulfide Reductase by Coenzyme A-Mimetics: Mechanistic and Structural Insights.
Biochemistry, 51, 2012
4EQW
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BU of 4eqw by Molmil
Crystal Structure of the Y361F, Y419F Mutant of Staphylococcus aureus CoADR
Descriptor: CHLORIDE ION, COENZYME A, Coenzyme A disulfide reductase, ...
Authors:Edwards, J.S, Wallace, B.D, Wallen, J.R, Claiborne, A, Redinbo, M.R.
Deposit date:2012-04-19
Release date:2012-10-17
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Turnover-Dependent Covalent Inactivation of Staphylococcus aureus Coenzyme A-Disulfide Reductase by Coenzyme A-Mimetics: Mechanistic and Structural Insights.
Biochemistry, 51, 2012
4EM3
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BU of 4em3 by Molmil
Crystal Structure of Staphylococcus aureus bound with the covalent inhibitor MeVS-CoA
Descriptor: CHLORIDE ION, Coenzyme A disulfide reductase, FLAVIN-ADENINE DINUCLEOTIDE, ...
Authors:Wallace, B.D, Edwards, J.S, Claiborne, A, Redinbo, M.R.
Deposit date:2012-04-11
Release date:2012-10-17
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (1.977 Å)
Cite:Turnover-Dependent Covalent Inactivation of Staphylococcus aureus Coenzyme A-Disulfide Reductase by Coenzyme A-Mimetics: Mechanistic and Structural Insights.
Biochemistry, 51, 2012
4EQS
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BU of 4eqs by Molmil
Crystal structure of the Y419F mutant of Staphylococcus aureus CoADR
Descriptor: CHLORIDE ION, COENZYME A, Coenzyme A disulfide reductase, ...
Authors:Wallace, B.D, Edwards, J.S, Wallen, J.R, Claiborne, A, Redinbo, M.R.
Deposit date:2012-04-19
Release date:2012-10-17
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Turnover-Dependent Covalent Inactivation of Staphylococcus aureus Coenzyme A-Disulfide Reductase by Coenzyme A-Mimetics: Mechanistic and Structural Insights.
Biochemistry, 51, 2012
4EM4
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BU of 4em4 by Molmil
Crystal Structure of Staphylococcus aureus bound with the covalent inhibitor Pethyl-VS-CoA
Descriptor: CHLORIDE ION, Coenzyme A disulfide reductase, FLAVIN-ADENINE DINUCLEOTIDE, ...
Authors:Wallace, B.D, Edwards, J.S, Claiborne, A, Redinbo, M.R.
Deposit date:2012-04-11
Release date:2012-10-17
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (1.821 Å)
Cite:Turnover-Dependent Covalent Inactivation of Staphylococcus aureus Coenzyme A-Disulfide Reductase by Coenzyme A-Mimetics: Mechanistic and Structural Insights.
Biochemistry, 51, 2012
5ELZ
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BU of 5elz by Molmil
Staphylococcus aureus Type II pantothenate kinase in complex with a pantothenate analog
Descriptor: ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, N-(1,3-benzodioxol-5-ylmethyl)-N~3~-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alaninamide, ...
Authors:Mottaghi, K, Hughes, S.J, Tempel, W, Hong, B, Park, H, Structural Genomics Consortium (SGC)
Deposit date:2015-11-05
Release date:2016-08-10
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Discovery of Potent Pantothenamide Inhibitors of Staphylococcus aureus Pantothenate Kinase through a Minimal SAR Study: Inhibition Is Due to Trapping of the Product.
Acs Infect Dis., 2, 2016
5EYK
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BU of 5eyk by Molmil
CRYSTAL STRUCTURE OF AURORA B IN COMPLEX WITH BI 847325
Descriptor: 3-[(3~{Z})-3-[[[4-[(dimethylamino)methyl]phenyl]amino]-phenyl-methylidene]-2-oxidanylidene-1~{H}-indol-6-yl]-~{N}-ethyl-prop-2-ynamide, Aurora kinase B-A, Inner centromere protein A
Authors:Bader, G, Zoephel, A.
Deposit date:2015-11-25
Release date:2016-08-17
Last modified:2016-10-19
Method:X-RAY DIFFRACTION (1.93 Å)
Cite:Pharmacological Profile of BI 847325, an Orally Bioavailable, ATP-Competitive Inhibitor of MEK and Aurora Kinases.
Mol.Cancer Ther., 15, 2016
5EYM
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BU of 5eym by Molmil
MEK1 IN COMPLEX WITH BI 847325
Descriptor: 3-[(3~{Z})-3-[[[4-[(dimethylamino)methyl]phenyl]amino]-phenyl-methylidene]-2-oxidanylidene-1~{H}-indol-6-yl]-~{N}-ethyl-prop-2-ynamide, CALCIUM ION, Dual specificity mitogen-activated protein kinase kinase 1
Authors:Bader, G, Reiser, U, Zahn, S.K, Treu, M.
Deposit date:2015-11-25
Release date:2016-08-17
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Pharmacological Profile of BI 847325, an Orally Bioavailable, ATP-Competitive Inhibitor of MEK and Aurora Kinases.
Mol.Cancer Ther., 15, 2016
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