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3A8H
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BU of 3a8h by Molmil
Crystal structure of Nitrile Hydratase mutant S113A complexed with Trimethylacetamide
Descriptor: 2,2-dimethylpropanamide, FE (III) ION, Nitrile hydratase subunit alpha, ...
Authors:Yamanaka, Y, Hashimoto, K, Ohtaki, A, Noguchi, K, Yohda, M, Odaka, M.
Deposit date:2009-10-06
Release date:2010-04-14
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.66 Å)
Cite:Kinetic and structural studies on roles of the serine ligand and a strictly conserved tyrosine residue in nitrile hydratase
J.Biol.Inorg.Chem., 15, 2010
2BH4
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BU of 2bh4 by Molmil
X-ray structure of the M100K variant of ferric cyt c-550 from Paracoccus versutus determined at 100 K.
Descriptor: CYTOCHROME C-550, HEME C
Authors:Worrall, J.A.R, Van Roon, A.-M.M, Ubbink, M, Canters, G.W.
Deposit date:2005-01-07
Release date:2005-05-11
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:The Effect of Replacing the Axial Methionine Ligand with a Lysine Residue in Cytochrome C-550 from Paracoccus Versutus Assessed by X-Ray Crystallography and Unfolding.
FEBS J., 272, 2005
1FW3
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BU of 1fw3 by Molmil
OUTER MEMBRANE PHOSPHOLIPASE A FROM ESCHERICHIA COLI
Descriptor: OUTER MEMBRANE PHOSPHOLIPASE A
Authors:Snijder, H.J, Kingma, R.L, Kalk, K.H, Dekker, N, Egmond, M.R, Dijkstra, B.W.
Deposit date:2000-09-21
Release date:2001-06-01
Last modified:2022-12-21
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Structural investigations of calcium binding and its role in activity and activation of outer membrane phospholipase A from Escherichia coli.
J.Mol.Biol., 309, 2001
1EVI
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BU of 1evi by Molmil
THREE-DIMENSIONAL STRUCTURE OF THE PURPLE INTERMEDIATE OF PORCINE KIDNEY D-AMINO ACID OXIDASE
Descriptor: 3,4-DIHYDRO-2H-PYRROLIUM-5-CARBOXYLATE, D-AMINO ACID OXIDASE, FLAVIN-ADENINE DINUCLEOTIDE
Authors:Mizutani, H, Miyahara, I, Hirotsu, K, Nishina, Y, Shiga, K, Setoyama, C, Miura, R.
Deposit date:2000-04-20
Release date:2000-10-23
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Three-dimensional structure of the purple intermediate of porcine kidney D-amino acid oxidase. Optimization of the oxidative half-reaction through alignment of the product with reduced flavin.
J.Biochem.(Tokyo), 128, 2000
2HEZ
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BU of 2hez by Molmil
Bifidobacterium longum bile salt hydrolase
Descriptor: Bile salt hydrolase, SULFATE ION
Authors:Suresh, C.G, Kumar, R.S, Brannigan, J.A.
Deposit date:2006-06-22
Release date:2006-09-19
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural and Functional Analysis of a Conjugated Bile Salt Hydrolase from Bifidobacterium longum Reveals an Evolutionary Relationship with Penicillin V Acylase.
J.Biol.Chem., 281, 2006
2Z7R
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BU of 2z7r by Molmil
Crystal Structure of the N-terminal Kinase Domain of Human RSK1 bound to Staurosporine
Descriptor: Ribosomal protein S6 kinase alpha-1, STAUROSPORINE
Authors:Ikuta, M, Munshi, S.K.
Deposit date:2007-08-28
Release date:2008-05-13
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal structures of the N-terminal kinase domain of human RSK1 bound to three different ligands: Implications for the design of RSK1 specific inhibitors.
Protein Sci., 16, 2007
3PE6
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BU of 3pe6 by Molmil
Crystal Structure of a soluble form of human MGLL in complex with an inhibitor
Descriptor: (2-cyclohexyl-1,3-benzoxazol-6-yl){3-[4-(pyrimidin-2-yl)piperazin-1-yl]azetidin-1-yl}methanone, Monoglyceride lipase
Authors:Schubert, C, Schalk-Hih, C.
Deposit date:2010-10-25
Release date:2011-03-02
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:Crystal structure of a soluble form of human monoglyceride lipase in complex with an inhibitor at 1.35 A resolution.
Protein Sci., 20, 2011
1FW2
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BU of 1fw2 by Molmil
OUTER MEMBRANE PHOSPHOLIPASE A FROM ESCHERICHIA COLI
Descriptor: CALCIUM ION, OUTER MEMBRANE PHOSPHOLIPASE A
Authors:Snijder, H.J, Kingma, R.L, Kalk, K.H, Dekker, N, Egmond, M.R, Dijkstra, B.W.
Deposit date:2000-09-21
Release date:2001-06-01
Last modified:2024-05-22
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Structural investigations of calcium binding and its role in activity and activation of outer membrane phospholipase A from Escherichia coli.
J.Mol.Biol., 309, 2001
1TWO
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BU of 1two by Molmil
NMR structure of the pheromone binding protein from Antheraea polyphemus at acidic pH
Descriptor: Pheromone-binding protein
Authors:Mohanty, S, Zubkov, S.
Deposit date:2004-07-01
Release date:2005-10-25
Last modified:2024-10-16
Method:SOLUTION NMR
Cite:Structural Consequences of the pH-induced Conformational Switch in A.polyphemus Pheromone-binding Protein: Mechanisms of Ligand Release
J.Mol.Biol., 354, 2005
2ZEZ
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BU of 2zez by Molmil
Family 16 Carbohydrate Binding Module-2
Descriptor: CALCIUM ION, S-layer associated multidomain endoglucanase
Authors:Bae, B, Nair, S.K.
Deposit date:2007-12-18
Release date:2008-03-25
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Molecular Basis for the Selectivity and Specificity of Ligand Recognition by the Family 16 Carbohydrate-binding Modules from Thermoanaerobacterium polysaccharolyticum ManA
J.Biol.Chem., 283, 2008
7UNP
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BU of 7unp by Molmil
Crystal structure of the CelR catalytic domain and CBM3c
Descriptor: CALCIUM ION, Glucanase
Authors:Bingman, C.A, Kuch, N, Kutsche, M.E, Parker, A, Smith, R.W, Fox, B.G.
Deposit date:2022-04-11
Release date:2023-04-05
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2 Å)
Cite:Contribution of calcium ligands in substrate binding and product release in the Acetovibrio thermocellus glycoside hydrolase family 9 cellulase CelR.
J.Biol.Chem., 299, 2023
6Z66
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BU of 6z66 by Molmil
Crystal structure of apo-state neurotensin receptor 1
Descriptor: Neurotensin receptor type 1,Neurotensin receptor type 1,DARPin
Authors:Deluigi, M, Klipp, A, Hilge, M, Merklinger, L, Klenk, C, Plueckthun, A.
Deposit date:2020-05-27
Release date:2021-02-10
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (3.192 Å)
Cite:Complexes of the neurotensin receptor 1 with small-molecule ligands reveal structural determinants of full, partial, and inverse agonism.
Sci Adv, 7, 2021
7VEZ
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BU of 7vez by Molmil
Crystal structure of Cyclosorus parasiticus chalcone synthase 1 (CpCHS1) complex with naringenin
Descriptor: NARINGENIN, chalcone synthases 1
Authors:Li, J.X, Cheng, A.X.
Deposit date:2021-09-10
Release date:2021-11-10
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.397 Å)
Cite:Functional and Structural Investigation of Chalcone Synthases Based on Integrated Metabolomics and Transcriptome Analysis on Flavonoids and Anthocyanins Biosynthesis of the Fern Cyclosorus parasiticus .
Front Plant Sci, 12, 2021
7VF0
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BU of 7vf0 by Molmil
Crystal structure of Cyclosorus parasiticus chalcone synthase 1 (CpCHS1) complex with naringenin and CoA
Descriptor: COENZYME A, NARINGENIN, chalcone synthase
Authors:Li, J.X, Cheng, A.X.
Deposit date:2021-09-10
Release date:2021-11-10
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.399 Å)
Cite:Functional and Structural Investigation of Chalcone Synthases Based on Integrated Metabolomics and Transcriptome Analysis on Flavonoids and Anthocyanins Biosynthesis of the Fern Cyclosorus parasiticus .
Front Plant Sci, 12, 2021
7VEY
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BU of 7vey by Molmil
Crystal structure of Cyclosorus parasiticus chalcone synthase 1 (CpCHS1)
Descriptor: chalcone synthases
Authors:Li, J.X, Cheng, A.X.
Deposit date:2021-09-10
Release date:2021-11-10
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Functional and Structural Investigation of Chalcone Synthases Based on Integrated Metabolomics and Transcriptome Analysis on Flavonoids and Anthocyanins Biosynthesis of the Fern Cyclosorus parasiticus .
Front Plant Sci, 12, 2021
7VC6
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BU of 7vc6 by Molmil
The structure of beta-xylosidase from Phanerochaete chrysosporium(PcBxl3)
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, GLYCEROL, xylan 1,4-beta-xylosidase
Authors:Kojima, K, Sunagawa, N, Igarashi, K.
Deposit date:2021-09-01
Release date:2022-02-09
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2.54 Å)
Cite:Comparison of glycoside hydrolase family 3 beta-xylosidases from basidiomycetes and ascomycetes reveals evolutionarily distinct xylan degradation systems.
J.Biol.Chem., 298, 2022
7VC7
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BU of 7vc7 by Molmil
The structure of beta-xylosidase from Phanerochaete chrysosporium(PcBxl3)
Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, DI(HYDROXYETHYL)ETHER, ...
Authors:Kojima, K, Sunagawa, N, Igarashi, K.
Deposit date:2021-09-01
Release date:2022-02-09
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (3.08 Å)
Cite:Comparison of glycoside hydrolase family 3 beta-xylosidases from basidiomycetes and ascomycetes reveals evolutionarily distinct xylan degradation systems.
J.Biol.Chem., 298, 2022
2ZQZ
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BU of 2zqz by Molmil
R-state structure of allosteric L-lactate dehydrogenase from Lactobacillus casei
Descriptor: L-lactate dehydrogenase, SULFATE ION
Authors:Arai, K, Ishimitsu, T, Fushinobu, S, Uchikoba, H, Matsuzawa, H, Taguchi, H.
Deposit date:2008-08-22
Release date:2009-09-08
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Active and inactive state structures of unliganded Lactobacillus casei allosteric L-lactate dehydrogenase.
Proteins, 78, 2010
2ZEW
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BU of 2zew by Molmil
Family 16 Cabohydrate Binding Domain Module 1
Descriptor: CALCIUM ION, S-layer associated multidomain endoglucanase
Authors:Bae, B, Nair, S.K.
Deposit date:2007-12-18
Release date:2008-03-04
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Molecular Basis for the Selectivity and Specificity of Ligand Recognition by the Family 16 Carbohydrate-binding Modules from Thermoanaerobacterium polysaccharolyticum ManA
J.Biol.Chem., 283, 2008
8AY2
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BU of 8ay2 by Molmil
Crystal structure of the C-terminal part of rat Sec8
Descriptor: Exocyst complex component 4
Authors:Dong, G, Lesigang, J.
Deposit date:2022-09-01
Release date:2023-09-13
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Sec8 specifically interacts with the PDZ2 domain of synapse associated protein 102 (SAP102).
Front Cell Dev Biol, 11, 2023
6Z6Z
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BU of 6z6z by Molmil
Crystal structure of an Anticalin directed towards colchicine without ligand
Descriptor: CALCIUM ION, Neutrophil gelatinase-associated lipocalin
Authors:Skerra, A, Eichinger, A.
Deposit date:2020-05-29
Release date:2021-06-09
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.78 Å)
Cite:Structural rearrangement in the ligand pocket of Colchicalin upon Colchicine binding
To be published
1Q9S
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BU of 1q9s by Molmil
Crystal structure of riboflavin kinase with ternary product complex
Descriptor: ADENOSINE-5'-DIPHOSPHATE, FLAVIN MONONUCLEOTIDE, MAGNESIUM ION, ...
Authors:Karthikeyan, S, Zhou, Q, Osterman, A.L, Zhang, H.
Deposit date:2003-08-25
Release date:2003-12-16
Last modified:2024-12-25
Method:X-RAY DIFFRACTION (2.42 Å)
Cite:Ligand binding-induced conformational changes in riboflavin kinase: structural basis for the ordered mechanism.
Biochemistry, 42, 2003
8B4G
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BU of 8b4g by Molmil
Structure of a fungal LPMO bound to ligands
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, ACRYLIC ACID, CHLORIDE ION, ...
Authors:Banerjee, S, Huang, Z, Brander, S, Johansen, K.S, Lo Leggio, L.
Deposit date:2022-09-20
Release date:2024-04-03
Method:X-RAY DIFFRACTION (1.496 Å)
Cite:Structure of a fungal LPMO bound to ligands
To Be Published
3OLM
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BU of 3olm by Molmil
Structure and Function of a Ubiquitin Binding Site within the Catalytic Domain of a HECT Ubiquitin Ligase
Descriptor: E3 ubiquitin-protein ligase RSP5, Ubiquitin
Authors:Kim, H.C, Steffen, A, Chen, J, Huibregtse, J.M.
Deposit date:2010-08-26
Release date:2011-03-23
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.495 Å)
Cite:Structure and function of a HECT domain ubiquitin-binding site.
Embo Rep., 12, 2011
6FUH
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BU of 6fuh by Molmil
Complement factor D in complex with the inhibitor (4-((3-(aminomethyl)phenyl)amino)quinazolin-2-yl)-L-valine
Descriptor: (2~{S})-2-[[4-[[3-(aminomethyl)phenyl]amino]quinazolin-2-yl]amino]-3-methyl-butanoic acid, Complement factor D
Authors:Mac Sweeney, A, Ostermann, N, Vulpetti, A, Maibaum, J, Erbel, P, Lorthiois, E, Yoon, T, Randl, S, Ruedisser, S.
Deposit date:2018-02-27
Release date:2018-06-06
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (1.37 Å)
Cite:Discovery and Design of First Benzylamine-Based Ligands Binding to an Unlocked Conformation of the Complement Factor D.
ACS Med Chem Lett, 9, 2018

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