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PDB: 144 results

5R43
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BU of 5r43 by Molmil
Crystal Structure of deuterated gamma-Chymotrypsin at pH 7.5, cryo temperature
Descriptor: Chymotrypsinogen A, IODIDE ION, MALONIC ACID, ...
Authors:Kreinbring, C.A, Wilson, M.A, Kovalevsky, A.Y, Blakeley, M.P, Fisher, S.Z, Lazar, L.M, Moulin, A.G, Novak, W.R, Petsko, G.A, Ringe, D.
Deposit date:2020-02-18
Release date:2021-09-01
Method:X-RAY DIFFRACTION (1 Å)
Cite:Effect of Temperature and pH on Ionizable Residues in gamma-Chymotrypsin: a X-ray and Neutron Crystallography Study
To be published
5R4B
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BU of 5r4b by Molmil
Crystal Structure of deuterated gamma-Chymotrypsin at pH 9, cryo temperature
Descriptor: IODIDE ION, SULFATE ION, gamma-chymotrypsin, ...
Authors:Kreinbring, C.A, Wilson, M.A, Kovalevsky, A.Y, Blakeley, M.P, Fisher, S.Z, Lazar, L.M, Moulin, A.G, Novak, W.R, Petsko, G.A, Ringe, D.
Deposit date:2020-02-18
Release date:2021-09-01
Method:X-RAY DIFFRACTION (1.05 Å)
Cite:Effect of Temperature and pH on Ionizable Residues in gamma-Chymotrypsin: a X-ray and Neutron Crystallography Study
To be published
5R4D
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BU of 5r4d by Molmil
Crystal Structure of gamma-Chymotrypsin at pH 9, cryo temperature
Descriptor: IODIDE ION, SULFATE ION, gamma-chymotrypsin, ...
Authors:Kreinbring, C.A, Wilson, M.A, Kovalevsky, A.Y, Blakeley, M.P, Fisher, S.Z, Lazar, L.M, Moulin, A.G, Novak, W.R, Petsko, G.A, Ringe, D.
Deposit date:2020-02-18
Release date:2021-09-01
Method:X-RAY DIFFRACTION (1.05 Å)
Cite:Effect of Temperature and pH on Ionizable Residues in gamma-Chymotrypsin: a X-ray and Neutron Crystallography Study
To be published
5R47
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BU of 5r47 by Molmil
Crystal Structure of deuterated gamma-Chymotrypsin at pH 5.6, cryo temperature
Descriptor: IODIDE ION, MALONIC ACID, gamma-chymotrypsin, ...
Authors:Kreinbring, C.A, Wilson, M.A, Kovalevsky, A.Y, Blakeley, M.P, Fisher, S.Z, Lazar, L.M, Moulin, A.G, Novak, W.R, Petsko, G.A, Ringe, D.
Deposit date:2020-02-18
Release date:2021-09-01
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:Effect of Temperature and pH on Ionizable Residues in gamma-Chymotrypsin: a X-ray and Neutron Crystallography Study
To be published
4LRU
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BU of 4lru by Molmil
Crystal structure of glyoxalase III (Orf 19.251) from Candida albicans
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, Glyoxalase III (glutathione-independent)
Authors:Hasim, S, Hussin, N.A, Nickerson, K.W, Wilson, M.A.
Deposit date:2013-07-20
Release date:2013-08-07
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:A Glutathione-independent Glyoxalase of the DJ-1 Superfamily Plays an Important Role in Managing Metabolically Generated Methylglyoxal in Candida albicans.
J.Biol.Chem., 289, 2014
8OFF
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BU of 8off by Molmil
Structure of BARD1 ARD-BRCTs in complex with H2AKc15ub nucleosomes (Map1)
Descriptor: BRCA1 associated RING domain 1, DNA (142-MER), Histone H2A type 1, ...
Authors:Foglizzo, M, Burdett, H, Wilson, M.D, Zeqiraj, E.
Deposit date:2023-03-15
Release date:2023-10-11
Last modified:2023-11-22
Method:ELECTRON MICROSCOPY (3.4 Å)
Cite:BRCA1-BARD1 combines multiple chromatin recognition modules to bridge nascent nucleosomes.
Nucleic Acids Res., 51, 2023
6R0C
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BU of 6r0c by Molmil
Human-D02 Nucleosome Core Particle with biotin-streptavidin label
Descriptor: DNA (142-MER), Histone H2A type 1, Histone H2B type 1-C/E/F/G/I, ...
Authors:Pye, V.E, Wilson, M.D, Cherepanov, P, Costa, A.
Deposit date:2019-03-12
Release date:2019-09-25
Last modified:2024-05-15
Method:ELECTRON MICROSCOPY (4.2 Å)
Cite:Retroviral integration into nucleosomes through DNA looping and sliding along the histone octamer.
Nat Commun, 10, 2019
1Z2P
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BU of 1z2p by Molmil
Inositol 1,3,4-trisphosphate 5/6-Kinase in complex with Mg2+/AMP-PCP/Ins(1,3,4)P3
Descriptor: (1S,3S,4S)-1,3,4-TRIPHOSPHO-MYO-INOSITOL, MAGNESIUM ION, PHOSPHOMETHYLPHOSPHONIC ACID ADENYLATE ESTER, ...
Authors:Miller, G.J, Wilson, M.P, Majerus, P.W, Hurley, J.H.
Deposit date:2005-03-08
Release date:2005-04-19
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.22 Å)
Cite:Specificity determinants in inositol polyphosphate synthesis: crystal structure of inositol 1,3,4-trisphosphate 5/6-kinase.
Mol.Cell, 18, 2005
1Z2N
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BU of 1z2n by Molmil
Inositol 1,3,4-trisphosphate 5/6-kinase complexed Mg2+/ADP
Descriptor: ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, inositol 1,3,4-trisphosphate 5/6-kinase
Authors:Miller, G.J, Wilson, M.P, Majerus, P.W, Hurley, J.H.
Deposit date:2005-03-08
Release date:2005-04-19
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.2 Å)
Cite:Specificity determinants in inositol polyphosphate synthesis: crystal structure of inositol 1,3,4-trisphosphate 5/6-kinase.
Mol.Cell, 18, 2005
1Z2O
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BU of 1z2o by Molmil
Inositol 1,3,4-trisphosphate 5/6-Kinase in complex with mg2+/ADP/Ins(1,3,4,6)P4
Descriptor: (1S,3R,4R,6S)-1,3,4,6-TETRAPKISPHOSPHATE, ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
Authors:Miller, G.J, Wilson, M.P, Majerus, P.W, Hurley, J.H.
Deposit date:2005-03-08
Release date:2005-04-19
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.24 Å)
Cite:Specificity determinants in inositol polyphosphate synthesis: crystal structure of inositol 1,3,4-trisphosphate 5/6-kinase.
Mol.Cell, 18, 2005
6H00
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BU of 6h00 by Molmil
Crystal structure of human pyridoxine 5-phophate oxidase, R116Q variant
Descriptor: 1,2-ETHANEDIOL, FLAVIN MONONUCLEOTIDE, Pyridoxine-5'-phosphate oxidase, ...
Authors:Mackinnon, S, Wilson, M.P, Shrestha, L, Bezerra, G.A, Newman, J, Fox, N, Sorrell, F, Arrowsmith, C.H, Edwards, A, Bountra, C, Clayton, P.T, Mills, P.B, Yue, W.W.
Deposit date:2018-07-05
Release date:2018-08-08
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.66 Å)
Cite:Crystal structure of human pyridoxine 5-phophate oxidase, R116Q variant
To Be Published
4XLL
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BU of 4xll by Molmil
Toxoplasma gondii DJ-1, oxidized
Descriptor: DJ-1 family protein
Authors:Child, M.A, Wilson, M.A, Reese, M.L, Bogyo, M.
Deposit date:2015-01-13
Release date:2015-02-11
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2.08 Å)
Cite:Toxoplasma DJ-1 regulates microneme exocytosis through an association with the plant-like kinase, CDPK1
To Be Published
6NPQ
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BU of 6npq by Molmil
Pseudomonas fluorescens isocyanide hydratase at 298 K XFEL data
Descriptor: Isonitrile hydratase InhA
Authors:Dasgupta, M, van den Bedem, H, Wilson, M.A.
Deposit date:2019-01-18
Release date:2019-11-20
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Mix-and-inject XFEL crystallography reveals gated conformational dynamics during enzyme catalysis.
Proc.Natl.Acad.Sci.USA, 116, 2019
6UND
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BU of 6und by Molmil
Pseudomonas fluorescens isocyanide hydratase thioimidate intermediate at 298 K XFEL data
Descriptor: Isonitrile hydratase InhA, N-(4-nitrophenyl)methanimine
Authors:Dasgupta, M, van den Bedem, H, Wilson, M.A.
Deposit date:2019-10-11
Release date:2019-11-20
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Mix-and-inject XFEL crystallography reveals gated conformational dynamics during enzyme catalysis.
Proc.Natl.Acad.Sci.USA, 116, 2019
6UNF
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BU of 6unf by Molmil
Pseudomonas fluorescens isocyanide hydratase post-catalysis at 298 K XFEL data
Descriptor: Isonitrile hydratase InhA
Authors:Dasgupta, M, van den Bedem, H, Wilson, M.A.
Deposit date:2019-10-11
Release date:2019-11-20
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Mix-and-inject XFEL crystallography reveals gated conformational dynamics during enzyme catalysis.
Proc.Natl.Acad.Sci.USA, 116, 2019
5AGF
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BU of 5agf by Molmil
Nitrosyl complex of the D121Q variant of cytochrome c prime from Alcaligenes xylosoxidans
Descriptor: CYTOCHROME C PRIME, HEME C, NITRIC OXIDE, ...
Authors:Gahfoor, D.D, Kekilli, D, Abdullah, G.H, Dworkowski, F.S.N, Hassan, H.G, Wilson, M.T, Hough, M.A, Strange, R.W.
Deposit date:2015-01-30
Release date:2015-09-09
Last modified:2020-03-11
Method:X-RAY DIFFRACTION (1.09 Å)
Cite:Hydrogen Bonding of the Dissociated Histidine Ligand is not Required for Formation of a Proximal No Adduct in Cytochrome C'.
J.Biol.Inorg.Chem., 20, 2015
3NON
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BU of 3non by Molmil
Crystal Structure of Isocyanide Hydratase from Pseudomonas fluorescens
Descriptor: 1,2-ETHANEDIOL, Isocyanide hydratase
Authors:Lakshminarasimhan, M, Madzelan, P, Nan, R, Milkovic, N.M, Wilson, M.A.
Deposit date:2010-06-25
Release date:2010-07-14
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.05 Å)
Cite:Evolution of New Enzymatic Function by Structural Modulation of Cysteine Reactivity in Pseudomonas fluorescens Isocyanide Hydratase.
J.Biol.Chem., 285, 2010
3NOQ
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BU of 3noq by Molmil
Crystal Structure of C101S Isocyanide Hydratase from Pseudomonas fluorescens
Descriptor: 1,2-ETHANEDIOL, 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, ThiJ/PfpI family protein
Authors:Lakshminarasimhan, M, Madzelan, P, Nan, R, Milkovic, N.M, Wilson, M.A.
Deposit date:2010-06-25
Release date:2010-07-07
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1 Å)
Cite:Evolution of New Enzymatic Function by Structural Modulation of Cysteine Reactivity in Pseudomonas fluorescens Isocyanide Hydratase.
J.Biol.Chem., 285, 2010
3NOR
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BU of 3nor by Molmil
Crystal Structure of T102S Isocyanide Hydratase from Pseudomonas fluorescens
Descriptor: CITRIC ACID, ThiJ/PfpI family protein
Authors:Lakshminarasimhan, M, Madzelan, P, Nan, R, Milkovic, N.M, Wilson, M.A.
Deposit date:2010-06-25
Release date:2010-07-07
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Evolution of New Enzymatic Function by Structural Modulation of Cysteine Reactivity in Pseudomonas fluorescens Isocyanide Hydratase.
J.Biol.Chem., 285, 2010
3NOV
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BU of 3nov by Molmil
Crystal Structure of D17E Isocyanide Hydratase from Pseudomonas fluorescens
Descriptor: ACETATE ION, ThiJ/PfpI family protein
Authors:Lakshminarasimhan, M, Madzelan, P, Nan, R, Milkovic, N.M, Wilson, M.A.
Deposit date:2010-06-25
Release date:2010-07-07
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.05 Å)
Cite:Evolution of New Enzymatic Function by Structural Modulation of Cysteine Reactivity in Pseudomonas fluorescens Isocyanide Hydratase.
J.Biol.Chem., 285, 2010
3NOO
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BU of 3noo by Molmil
Crystal Structure of C101A Isocyanide Hydratase from Pseudomonas fluorescens
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, ThiJ/PfpI family protein
Authors:Lakshminarasimhan, M, Madzelan, P, Nan, R, Milkovic, N.M, Wilson, M.A.
Deposit date:2010-06-25
Release date:2010-07-07
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.03 Å)
Cite:Evolution of New Enzymatic Function by Structural Modulation of Cysteine Reactivity in Pseudomonas fluorescens Isocyanide Hydratase.
J.Biol.Chem., 285, 2010
8UVZ
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BU of 8uvz by Molmil
Bacillus subtilis DHFR bound to NADP+ and folate
Descriptor: Dihydrofolate reductase, FOLIC ACID, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Smith, N, Horswill, A.R, Wilson, M.A.
Deposit date:2023-11-05
Release date:2023-11-15
Method:X-RAY DIFFRACTION (0.93 Å)
Cite:Bacillus subtilis DHFR bound to NADP+ and folate
To Be Published
8UW0
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BU of 8uw0 by Molmil
Escherichia coli DHFR bound to NADP+ and folate, 17.2 MGy dose
Descriptor: Dihydrofolate reductase, FOLIC ACID, MANGANESE (II) ION, ...
Authors:Smith, N, Horswill, A.R, Wilson, M.A.
Deposit date:2023-11-05
Release date:2023-11-15
Method:X-RAY DIFFRACTION (0.93 Å)
Cite:X-ray-driven chemistry and conformational heterogeneity in atomic resolution crystal structures of bacterial dihydrofolate reductases
To Be Published
5FTZ
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BU of 5ftz by Molmil
AA10 lytic polysaccharide monooxygenase (LPMO) from Streptomyces lividans
Descriptor: CHITIN BINDING PROTEIN, COPPER (II) ION
Authors:Chaplin, A.K.C, Wilson, M.T, Hough, M.A, Svistunenko, D.A, Hemsworth, G.R, Walton, P.H, Vijgenboom, E, Worrall, J.A.R.
Deposit date:2016-01-19
Release date:2016-04-27
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.38 Å)
Cite:Heterogeneity in the Histidine-Brace Copper Coordination Sphere in Aa10 Lytic Polysaccharide Monooxygenases.
J.Biol.Chem., 291, 2016
3E64
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BU of 3e64 by Molmil
Fragment based discovery of JAK-2 inhibitors
Descriptor: 4-(3-amino-1H-indazol-5-yl)-N-tert-butylbenzenesulfonamide, Tyrosine-protein kinase JAK2
Authors:Antonysamy, S, Fang, W, Hirst, G, Park, F, Russell, M, Smyth, L, Sprengeler, P, Stappenbeck, F, Steensma, R, Thompson, D.A, Wilson, M, Wong, M, Zhang, A, Zhang, F.
Deposit date:2008-08-14
Release date:2008-10-14
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Fragment-based discovery of JAK-2 inhibitors.
Bioorg.Med.Chem.Lett., 19, 2009

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