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1ARZ
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BU of 1arz by Molmil
ESCHERICHIA COLI DIHYDRODIPICOLINATE REDUCTASE IN COMPLEX WITH NADH AND 2,6 PYRIDINE DICARBOXYLATE
Descriptor: 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE, DIHYDRODIPICOLINATE REDUCTASE, PHOSPHATE ION, ...
Authors:Scapin, G, Reddy, S.G, Zheng, R, Blanchard, J.S.
Deposit date:1997-08-08
Release date:1998-10-14
Last modified:2023-08-02
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Three-dimensional structure of Escherichia coli dihydrodipicolinate reductase in complex with NADH and the inhibitor 2,6-pyridinedicarboxylate.
Biochemistry, 36, 1997
1BWZ
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BU of 1bwz by Molmil
DIAMINOPIMELATE EPIMERASE FROM HEMOPHILUS INFLUENZAE
Descriptor: PROTEIN (DIAMINOPIMELATE EPIMERASE)
Authors:Cirilli, M, Zheng, R, Scapin, G, Blanchard, J.S.
Deposit date:1998-09-29
Release date:1998-12-16
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (2.72 Å)
Cite:Structural symmetry: the three-dimensional structure of Haemophilus influenzae diaminopimelate epimerase.
Biochemistry, 37, 1998
1C3V
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BU of 1c3v by Molmil
DIHYDRODIPICOLINATE REDUCTASE FROM MYCOBACTERIUM TUBERCULOSIS COMPLEXED WITH NADPH AND PDC
Descriptor: DIHYDRODIPICOLINATE REDUCTASE, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, PYRIDINE-2,6-DICARBOXYLIC ACID, ...
Authors:Cirilli, M, Zheng, R, Scapin, G, Blanchard, J.S, TB Structural Genomics Consortium (TBSGC)
Deposit date:1999-07-28
Release date:2003-08-26
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.39 Å)
Cite:The three-dimensional structures of the Mycobacterium tuberculosis dihydrodipicolinate reductase-NADH-2,6-PDC and -NADPH-2,6-PDC complexes. Structural and mutagenic analysis of relaxed nucleotide specificity
Biochemistry, 42, 2003
1RR2
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BU of 1rr2 by Molmil
Propionibacterium shermanii transcarboxylase 5S subunit bound to 2-ketobutyric acid
Descriptor: 2-KETOBUTYRIC ACID, COBALT (II) ION, transcarboxylase 5S subunit
Authors:Hall, P.R, Zheng, R, Antony, L, Pusztai-Carey, M, Carey, P.R, Yee, V.C.
Deposit date:2003-12-08
Release date:2004-09-07
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2 Å)
Cite:Transcarboxylase 5S structures: assembly and catalytic mechanism of a multienzyme complex subunit.
Embo J., 23, 2004
1RQB
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BU of 1rqb by Molmil
Propionibacterium shermanii transcarboxylase 5S subunit
Descriptor: COBALT (II) ION, transcarboxylase 5S subunit
Authors:Hall, P.R, Zheng, R, Antony, L, Pusztai-Carey, M, Carey, P.R, Yee, V.C.
Deposit date:2003-12-04
Release date:2004-09-07
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Transcarboxylase 5S structures: assembly and catalytic mechanism of a multienzyme complex subunit.
Embo J., 23, 2004
1RQH
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BU of 1rqh by Molmil
Propionibacterium shermanii transcarboxylase 5S subunit bound to pyruvic acid
Descriptor: COBALT (II) ION, PYRUVIC ACID, transcarboxylase 5S subunit
Authors:Hall, P.R, Zheng, R, Antony, L, Pusztai-Carey, M, Carey, P.R, Yee, V.C.
Deposit date:2003-12-05
Release date:2004-09-07
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2 Å)
Cite:Transcarboxylase 5S structures: assembly and catalytic mechanism of a multienzyme complex subunit.
Embo J., 23, 2004
1RQE
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BU of 1rqe by Molmil
Propionibacterium shermanii transcarboxylase 5S subunit bound to oxaloacetate
Descriptor: COBALT (II) ION, OXALOACETATE ION, transcarboxylase 5S subunit
Authors:Hall, P.R, Zheng, R, Antony, L, Pusztai-Carey, M, Carey, P.R, Yee, V.C.
Deposit date:2003-12-05
Release date:2004-09-07
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Transcarboxylase 5S structures: assembly and catalytic mechanism of a multienzyme complex subunit.
Embo J., 23, 2004
1S3H
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BU of 1s3h by Molmil
Propionibacterium shermanii transcarboxylase 5S subunit A59T
Descriptor: COBALT (II) ION, transcarboxylase 5S subunit
Authors:Hall, P.R, Zheng, R, Antony, L, Pusztai-Carey, M, Carey, P.R, Yee, V.C.
Deposit date:2004-01-13
Release date:2004-09-07
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Transcarboxylase 5S structures: assembly and catalytic mechanism of a multienzyme complex subunit.
Embo J., 23, 2004
1U5J
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BU of 1u5j by Molmil
Propionibacterium shermanii transcarboxylase 5S subunit, Met186Ile
Descriptor: COBALT (II) ION, transcarboxylase 5S subunit
Authors:Hall, P.R, Zheng, R, Antony, L, Pusztai-Carey, M, Carey, P.R, Yee, V.C.
Deposit date:2004-07-27
Release date:2004-09-07
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Transcarboxylase 5S structures: assembly and catalytic mechanism of a multienzyme complex subunit.
Embo J., 23, 2004
1P9L
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BU of 1p9l by Molmil
Structure of M. tuberculosis dihydrodipicolinate reductase in complex with NADH and 2,6 PDC
Descriptor: 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE, PYRIDINE-2,6-DICARBOXYLIC ACID, TETRAETHYLENE GLYCOL, ...
Authors:Cirilli, M, Zheng, R, Scapin, G, Blanchard, J.S, TB Structural Genomics Consortium (TBSGC)
Deposit date:2003-05-12
Release date:2003-08-26
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:The three-dimensional structures of the Mycobacterium tuberculosis dihydrodipicolinate reductase-NADH-2,6-PDC and -NADPH-2,6-PDC complexes. Structural and mutagenic analysis of relaxed nucleotide specificity.
Biochemistry, 42, 2003
1WJF
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BU of 1wjf by Molmil
SOLUTION STRUCTURE OF H12C MUTANT OF THE N-TERMINAL ZN BINDING DOMAIN OF HIV-1 INTEGRASE COMPLEXED TO CADMIUM, NMR, 40 STRUCTURES
Descriptor: CADMIUM ION, HIV-1 INTEGRASE
Authors:Cai, M, Gronenborn, A.M, Clore, G.M.
Deposit date:1998-06-11
Release date:1998-12-16
Last modified:2018-03-14
Method:SOLUTION NMR
Cite:Solution structure of the His12 --> Cys mutant of the N-terminal zinc binding domain of HIV-1 integrase complexed to cadmium.
Protein Sci., 7, 1998
4TN2
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BU of 4tn2 by Molmil
NS5b in complex with lactam-thiophene carboxylic acids
Descriptor: 3-[(2R)-2-cyclohexyl-5-oxopyrrolidin-1-yl]-5-phenylthiophene-2-carboxylic acid, Genome polyprotein
Authors:Chopra, R.
Deposit date:2014-06-02
Release date:2014-09-17
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Design and synthesis of lactam-thiophene carboxylic acids as potent hepatitis C virus polymerase inhibitors.
Bioorg.Med.Chem.Lett., 24, 2014
4TLR
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BU of 4tlr by Molmil
NS5b in complex with lactam-thiophene carboxylic acids
Descriptor: 3-{(2R,5R)-5-cyclohexyl-2-[(2R)-2-hydroxypropyl]-3-oxomorpholin-4-yl}-5-(3,3-dimethylbut-1-yn-1-yl)thiophene-2-carboxylic acid, 5-cyclopropyl-2-(4-fluorophenyl)-6-[(2-hydroxyethyl)(methylsulfonyl)amino]-N-methyl-1-benzofuran-3-carboxamide, NS5b
Authors:Chopra, R.
Deposit date:2014-05-30
Release date:2014-12-10
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.86 Å)
Cite:Design and synthesis of lactam-thiophene carboxylic acids as potent hepatitis C virus polymerase inhibitors.
Bioorg.Med.Chem.Lett., 24, 2014
2EZX
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BU of 2ezx by Molmil
SOLUTION STRUCTURE OF HUMAN BARRIER-TO-AUTOINTEGRATION FACTOR BAF, NMR, REGULARIZED MEAN STRUCTURE
Descriptor: BARRIER-TO-AUTOINTEGRATION FACTOR
Authors:Clore, G.M, Cai, M, Gronenborn, A.M.
Deposit date:1998-07-26
Release date:1999-01-13
Last modified:2022-03-09
Method:SOLUTION NMR
Cite:Solution structure of the cellular factor BAF responsible for protecting retroviral DNA from autointegration.
Nat.Struct.Biol., 5, 1998
2EZY
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BU of 2ezy by Molmil
SOLUTION STRUCTURE OF HUMAN BARRIER-TO-AUTOINTEGRATION FACTOR BAF, NMR, ENSEMBLE OF 20 SIMULATED ANNEALING STRUCTURES
Descriptor: BARRIER-TO-AUTOINTEGRATION FACTOR
Authors:Clore, G.M, Cai, M, Gronenborn, A.M.
Deposit date:1998-07-26
Release date:1999-01-13
Last modified:2022-03-09
Method:SOLUTION NMR
Cite:Solution structure of the cellular factor BAF responsible for protecting retroviral DNA from autointegration.
Nat.Struct.Biol., 5, 1998
2EZZ
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BU of 2ezz by Molmil
SOLUTION STRUCTURE OF HUMAN BARRIER-TO-AUTOINTEGRATION FACTOR BAF NMR, ENSEMBLE OF 20 SIMULATED ANNEALING STRUCTURES
Descriptor: BARRIER-TO-AUTOINTEGRATION FACTOR
Authors:Clore, G.M, Cai, M, Gronenborn, A.M.
Deposit date:1998-07-26
Release date:1999-01-13
Last modified:2022-03-09
Method:SOLUTION NMR
Cite:Solution structure of the cellular factor BAF responsible for protecting retroviral DNA from autointegration.
Nat.Struct.Biol., 5, 1998
1WJB
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BU of 1wjb by Molmil
SOLUTION STRUCTURE OF THE N-TERMINAL ZN BINDING DOMAIN OF HIV-1 INTEGRASE (D FORM), NMR, 40 STRUCTURES
Descriptor: HIV-1 INTEGRASE, ZINC ION
Authors:Clore, G.M, Cai, M, Caffrey, M, Gronenborn, A.M.
Deposit date:1997-05-13
Release date:1998-05-13
Last modified:2022-03-02
Method:SOLUTION NMR
Cite:Solution structure of the N-terminal zinc binding domain of HIV-1 integrase.
Nat.Struct.Biol., 4, 1997
1WJA
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BU of 1wja by Molmil
SOLUTION STRUCTURE OF THE N-TERMINAL ZN BINDING DOMAIN OF HIV-1 INTEGRASE (D FORM), NMR, REGULARIZED MEAN STRUCTURE
Descriptor: HIV-1 INTEGRASE, ZINC ION
Authors:Clore, G.M, Cai, M, Caffrey, M, Gronenborn, A.M.
Deposit date:1997-05-13
Release date:1998-05-13
Last modified:2022-03-02
Method:SOLUTION NMR
Cite:Solution structure of the N-terminal zinc binding domain of HIV-1 integrase.
Nat.Struct.Biol., 4, 1997
1WJE
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BU of 1wje by Molmil
SOLUTION STRUCTURE OF H12C MUTANT OF THE N-TERMINAL ZN BINDING DOMAIN OF HIV-1 INTEGRASE COMPLEXED TO CADMIUM, NMR, MINIMIZED AVERAGE STRUCTURE
Descriptor: CADMIUM ION, HIV-1 INTEGRASE
Authors:Cai, M, Gronenborn, A.M, Clore, G.M.
Deposit date:1998-06-11
Release date:1998-12-16
Last modified:2018-03-14
Method:SOLUTION NMR
Cite:Solution structure of the His12 --> Cys mutant of the N-terminal zinc binding domain of HIV-1 integrase complexed to cadmium.
Protein Sci., 7, 1998
1WJD
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BU of 1wjd by Molmil
SOLUTION STRUCTURE OF THE N-TERMINAL ZN BINDING DOMAIN OF HIV-1 INTEGRASE (E FORM), NMR, 38 STRUCTURES
Descriptor: HIV-1 INTEGRASE, ZINC ION
Authors:Clore, G.M, Cai, M, Caffrey, M, Gronenborn, A.M.
Deposit date:1997-05-13
Release date:1998-05-13
Last modified:2022-03-02
Method:SOLUTION NMR
Cite:Solution structure of the N-terminal zinc binding domain of HIV-1 integrase.
Nat.Struct.Biol., 4, 1997
1WJC
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BU of 1wjc by Molmil
SOLUTION STRUCTURE OF THE N-TERMINAL ZN BINDING DOMAIN OF HIV-1 INTEGRASE (E FORM), NMR, REGULARIZED MEAN STRUCTURE
Descriptor: HIV-1 INTEGRASE, ZINC ION
Authors:Clore, G.M, Cai, M, Caffrey, M, Gronenborn, A.M.
Deposit date:1997-05-13
Release date:1998-05-13
Last modified:2022-03-02
Method:SOLUTION NMR
Cite:Solution structure of the N-terminal zinc binding domain of HIV-1 integrase.
Nat.Struct.Biol., 4, 1997
7SSB
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BU of 7ssb by Molmil
Co-structure of PKG1 regulatory domain with compound 33
Descriptor: 4-({(2S,3S)-3-[(1S)-1-(3,5-dichlorophenyl)-2-hydroxyethoxy]-2-phenylpiperidin-1-yl}methyl)-3-nitrobenzoic acid, cGMP-dependent protein kinase 1
Authors:Fischmann, T.O.
Deposit date:2021-11-10
Release date:2022-08-24
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Optimization and Mechanistic Investigations of Novel Allosteric Activators of PKG1 alpha.
J.Med.Chem., 65, 2022
1ZOS
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BU of 1zos by Molmil
Structure of 5'-methylthionadenosine/S-Adenosylhomocysteine nucleosidase from S. pneumoniae with a transition-state inhibitor MT-ImmA
Descriptor: (3S,4R)-2-(4-AMINO-5H-PYRROLO[3,2-D]PYRIMIDIN-7-YL)-5-[(METHYLSULFANYL)METHYL]PYRROLIDINE-3,4-DIOL, 5'-methylthioadenosine / S-adenosylhomocysteine nucleosidase
Authors:Shi, W, Singh, V, Zhen, R, Tyler, P.C, Furneaux, R.H, Almo, S.C, Schramm, V.L.
Deposit date:2005-05-13
Release date:2006-04-25
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Structure and inhibition of a quorum sensing target from Streptococcus pneumoniae.
Biochemistry, 45, 2006
1QCK
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BU of 1qck by Molmil
SOLUTION STRUCTURE OF HUMAN BARRIER-TO-AUTOINTEGRATION FACTOR BAF, NMR, REGULARIZED MEAN STRUCTURE PLUS 20 INDIVIDUAL SIMULATED ANNEALING STRUCTURES
Descriptor: PROTEIN (BARRIER-TO-AUTOINTEGRATION FACTOR)
Authors:Clore, G.M.
Deposit date:1999-05-06
Release date:1999-06-23
Last modified:2023-12-27
Method:SOLUTION NMR
Cite:IMPROVING THE PACKING AND ACCURACY OF NMR STRUCTURES WITH A PSEUDOPOTENTIAL FOR THE RADIUS OF GYRATION
J.Am.Chem.Soc., 121, 1999
3FOW
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BU of 3fow by Molmil
Plasmodium Purine Nucleoside Phosphorylase V66I-V73I-Y160F Mutant
Descriptor: 1,4-DIDEOXY-4-AZA-1-(S)-(9-DEAZAHYPOXANTHIN-9-YL)-D-RIBITOL, PHOSPHATE ION, Uridine phosphorylase, ...
Authors:Donaldson, T, Zhan, C.
Deposit date:2009-01-02
Release date:2009-12-29
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Structural determinants of the 5'-methylthioinosine specificity of Plasmodium purine nucleoside phosphorylase.
Plos One, 9, 2014

 

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