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1BVA
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BU of 1bva by Molmil
MANGANESE BINDING MUTANT IN CYTOCHROME C PEROXIDASE
分子名称: MANGANESE (II) ION, PROTEIN (CYTOCHROME C PEROXIDASE), PROTOPORPHYRIN IX CONTAINING FE
著者Wilcox, S.K, Mcree, D.E, Goodin, D.B.
登録日1998-09-15
公開日1998-12-23
最終更新日2023-08-09
実験手法X-RAY DIFFRACTION (1.89 Å)
主引用文献Rational design of a functional metalloenzyme: introduction of a site for manganese binding and oxidation into a heme peroxidase.
Biochemistry, 37, 1998
8R99
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BU of 8r99 by Molmil
A soakable crystal form of human CDK7 in complex with AMP-PNP
分子名称: Cyclin-dependent kinase 7, MAGNESIUM ION, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER
著者Mukherjee, M, Cleasby, A.
登録日2023-11-30
公開日2024-05-29
最終更新日2024-06-26
実験手法X-RAY DIFFRACTION (1.81 Å)
主引用文献Protein engineering enables a soakable crystal form of human CDK7 primed for high-throughput crystallography and structure-based drug design.
Structure, 2024
8JUA
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BU of 8jua by Molmil
Multifunctional cytochrome P450 enzyme IkaD from Streptomyces sp. ZJ306, in complex with epoxyikarugamycin
分子名称: (1Z,3E,5S,7R,8R,10R,11R,12S,13R,15S,16R,17S,19Z,26S)-11-ethyl-2-hydroxy-10-methyl-22,27-diaza-14 oxahexacyclo[24.2.1.05,17.07,16.013,15.08,12]nonacosa-1(2),3,19-triene-21,28,29-trione, Cytochrome P450, FORMIC ACID, ...
著者Zhang, Y.L, Zhang, L.P, Zhang, C.S.
登録日2023-06-26
公開日2023-11-15
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.00001121 Å)
主引用文献A Mechanistic Understanding of the Distinct Regio- and Chemoselectivity of Multifunctional P450s by Structural Comparison of IkaD and CftA Complexed with Common Substrates.
Angew.Chem.Int.Ed.Engl., 62, 2023
8R9O
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BU of 8r9o by Molmil
A soakable crystal form of human CDK7 in complex with AMP-PNP
分子名称: Cyclin-dependent kinase 7, ~{N}-[(1~{S})-2-(dimethylamino)-1-phenyl-ethyl]-6,6-dimethyl-3-[[4-(propanoylamino)phenyl]carbonylamino]-1,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide
著者Mukherjee, M, Cleasby, A.
登録日2023-11-30
公開日2024-05-29
最終更新日2024-06-26
実験手法X-RAY DIFFRACTION (2.22 Å)
主引用文献Protein engineering enables a soakable crystal form of human CDK7 primed for high-throughput crystallography and structure-based drug design.
Structure, 2024
3OPD
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BU of 3opd by Molmil
Crystal Structure of the N-terminal domain of an HSP90 from Trypanosoma Brucei, Tb10.26.1080 in the presence of a benzamide derivative
分子名称: 4-[6,6-dimethyl-4-oxo-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]-2-[(cis-4-hydroxycyclohexyl)amino]benzamide, Heat shock protein 83
著者Pizarro, J.C, Wernimont, A.K, Hutchinson, A, Sullivan, H, Chamberlain, K, Weadge, J, Cossar, D, Li, Y, Kozieradzki, I, Bochkarev, A, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Weigelt, J, Wyatt, P.G, Fairlamb, A.H, MacKenzie, C, Ferguson, M.A.J, Hui, R, Hills, T, Structural Genomics Consortium (SGC)
登録日2010-08-31
公開日2010-10-13
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Exploring the Trypanosoma brucei Hsp83 potential as a target for structure guided drug design.
PLoS Negl Trop Dis, 7, 2013
8D77
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BU of 8d77 by Molmil
Crystal structure of hen egg white lysozyme at 200 Kelvin (Duplicate)
分子名称: CHLORIDE ION, GLYCEROL, Lysozyme C, ...
著者Ribeiro, F.S, Lima, L.M.T.R.
登録日2022-06-07
公開日2023-05-10
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Linking B-factor and temperature-induced conformational transition.
Biophys.Chem., 298, 2023
7ZQ3
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BU of 7zq3 by Molmil
Crystal structure of photosynthetic glyceraldehyde-3-phosphate dehydrogenase from Chlamydomonas reinhardtii (CrGAPA) complexed with NADP+
分子名称: Glyceraldehyde-3-phosphate dehydrogenase A, chloroplastic, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
著者Fermani, S, Zaffagnini, M, Lemaire, S.D, Falini, G, Fanti, S, Rossi, J.
登録日2022-04-29
公開日2022-07-20
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Structural snapshots of nitrosoglutathione binding and reactivity underlying S-nitrosylation of photosynthetic GAPDH.
Redox Biol, 54, 2022
1KUW
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BU of 1kuw by Molmil
High-Resolution Structure and Localization of Amylin Nucleation Site in Detergent Micelles
分子名称: Islet amyloid polypeptide
著者Mascioni, A, Porcelli, F, Ilangovan, U, Ramamoorthy, A, Veglia, G.
登録日2002-01-22
公開日2003-09-02
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献Conformational preferences of the amylin nucleation site in SDS micelles: an NMR study.
Biopolymers, 69, 2003
1BY4
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BU of 1by4 by Molmil
STRUCTURE AND MECHANISM OF THE HOMODIMERIC ASSEMBLY OF THE RXR ON DNA
分子名称: DNA (5'-D(*C*TP*AP*GP*GP*TP*CP*AP*AP*AP*GP*GP*TP*CP*AP*G)-3'), DNA (5'-D(*CP*TP*GP*AP*CP*CP*TP*TP*TP*GP*AP*CP*CP*TP*A)-3'), PROTEIN (RETINOIC ACID RECEPTOR RXR-ALPHA), ...
著者Zhao, Q, Chasse, S.A, Devarakonda, S, Sierk, M.L, Ahvazi, B, Sigler, P.B, Rastinejad, F.
登録日1998-10-22
公開日2000-01-12
最終更新日2023-08-09
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structural basis of RXR-DNA interactions.
J.Mol.Biol., 296, 2000
3PON
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BU of 3pon by Molmil
Crystal structure of MBL collagen-like peptide
分子名称: MBL collagen-like peptide
著者Gingras, A.R, Moody, P.C.E, Wallis, R.
登録日2010-11-23
公開日2011-08-24
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Structural Basis of Mannan-Binding Lectin Recognition by Its Associated Serine Protease MASP-1: Implications for Complement Activation.
Structure, 19, 2011
3POW
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BU of 3pow by Molmil
Crystal structure of the globular domain of human calreticulin
分子名称: CALCIUM ION, calreticulin
著者Gaboriaud, C.
登録日2010-11-23
公開日2011-03-09
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献X-ray structure of the human calreticulin globular domain reveals a Peptide-binding area and suggests a multi-molecular mechanism
Plos One, 6, 2011
7JY8
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BU of 7jy8 by Molmil
Analysis of a strand exchange reaction with a mini filament of 9-RecA, 27-mer ssDNA, partially-homologous 67 bp dsDNA and ATPgammaS
分子名称: DNA (27-MER), DNA (5'-D(P*AP*AP*AP*AP*AP*AP*AP*AP*AP*A)-3'), MAGNESIUM ION, ...
著者Pavletich, N.P.
登録日2020-08-29
公開日2020-11-04
最終更新日2024-03-06
実験手法ELECTRON MICROSCOPY (2.4 Å)
主引用文献Mechanism of strand exchange from RecA-DNA synaptic and D-loop structures.
Nature, 586, 2020
7K1Y
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BU of 7k1y by Molmil
PIKfyve/Fig4/Vac14 complex centered on Vac14 - map1
分子名称: Vac14
著者Lees, J.A, Reinisch, K.M, Li, P.
登録日2020-09-08
公開日2020-10-21
最終更新日2024-03-06
実験手法ELECTRON MICROSCOPY (5.25 Å)
主引用文献Insights into Lysosomal PI(3,5)P 2 Homeostasis from a Structural-Biochemical Analysis of the PIKfyve Lipid Kinase Complex.
Mol.Cell, 80, 2020
8D62
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BU of 8d62 by Molmil
Crystal structure of hen egg white lysozyme at 150 Kelvin (Triplicate)
分子名称: CHLORIDE ION, GLYCEROL, Lysozyme C, ...
著者Ribeiro, F.S, Lima, L.M.T.R.
登録日2022-06-06
公開日2023-05-10
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Linking B-factor and temperature-induced conformational transition.
Biophys.Chem., 298, 2023
8D7Q
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BU of 8d7q by Molmil
Crystal structure of hen egg white lysozyme at 250 Kelvin (Triplicate)
分子名称: CHLORIDE ION, GLYCEROL, Lysozyme C, ...
著者Ribeiro, F.S, Lima, L.M.T.R.
登録日2022-06-07
公開日2023-05-10
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Linking B-factor and temperature-induced conformational transition.
Biophys.Chem., 298, 2023
8D61
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BU of 8d61 by Molmil
Crystal structure of hen egg white lysozyme at 150 Kelvin (Duplicate)
分子名称: CHLORIDE ION, GLYCEROL, Lysozyme C, ...
著者Ribeiro, F.S, Lima, L.M.T.R.
登録日2022-06-06
公開日2023-05-10
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Linking B-factor and temperature-induced conformational transition.
Biophys.Chem., 298, 2023
7K41
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BU of 7k41 by Molmil
Bacterial O-GlcNAcase (OGA) with compound
分子名称: 1,2-ETHANEDIOL, 4-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyrimidin-2-amine, ACETATE ION, ...
著者Lane, W, Tjhen, R, Snell, G, Sang, B.
登録日2020-09-14
公開日2021-01-13
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Discovery of a Novel and Brain-Penetrant O -GlcNAcase Inhibitor via Virtual Screening, Structure-Based Analysis, and Rational Lead Optimization.
J.Med.Chem., 64, 2021
8D8A
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BU of 8d8a by Molmil
Crystal structure of hen egg white lysozyme at 275 Kelvin (Duplicate)
分子名称: CHLORIDE ION, GLYCEROL, Lysozyme C, ...
著者Ribeiro, F.S, Lima, L.M.T.R.
登録日2022-06-08
公開日2023-05-10
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Linking B-factor and temperature-induced conformational transition.
Biophys.Chem., 298, 2023
5URG
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BU of 5urg by Molmil
rat CYPOR D632F mutant
分子名称: FLAVIN MONONUCLEOTIDE, FLAVIN-ADENINE DINUCLEOTIDE, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
著者Xia, C, Kim, J.J.
登録日2017-02-10
公開日2018-02-14
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Structural and Kinetic Studies of Asp632 Mutants and Fully Reduced NADPH-Cytochrome P450 Oxidoreductase Define the Role of Asp632 Loop Dynamics in the Control of NADPH Binding and Hydride Transfer.
Biochemistry, 57, 2018
5YHI
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BU of 5yhi by Molmil
Crystal structure of YiiM from Escherichia coli
分子名称: PHOSPHATE ION, Protein YiiM
著者Namgung, B, Kim, J.H, Song, W.S, Yoon, S.I.
登録日2017-09-28
公開日2018-03-07
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.85 Å)
主引用文献Crystal structure of the hydroxylaminopurine resistance protein, YiiM, and its putative molybdenum cofactor-binding catalytic site.
Sci Rep, 8, 2018
8D6I
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BU of 8d6i by Molmil
Crystal structure of hen egg white lysozyme at 175 Kelvin (Triplicate)
分子名称: CHLORIDE ION, GLYCEROL, Lysozyme C, ...
著者Ribeiro, F.S, Lima, L.M.T.R.
登録日2022-06-06
公開日2023-05-10
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Linking B-factor and temperature-induced conformational transition.
Biophys.Chem., 298, 2023
7K4U
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BU of 7k4u by Molmil
Crystal structure of Kemp Eliminase HG3 K50Q in complex with the transition state analog 6-nitrobenzotriazole
分子名称: 6-NITROBENZOTRIAZOLE, Endo-1,4-beta-xylanase
著者Padua, R.A.P, Otten, R, Bunzel, A, Nguyen, V, Pitsawong, W, Patterson, M, Sui, S, Perry, S.L, Cohen, A.E, Hilvert, D, Kern, D.
登録日2020-09-16
公開日2020-12-02
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献How directed evolution reshapes the energy landscape in an enzyme to boost catalysis.
Science, 370, 2020
8D75
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BU of 8d75 by Molmil
Crystal structure of hen egg white lysozyme at 200 Kelvin
分子名称: CHLORIDE ION, GLYCEROL, Lysozyme C, ...
著者Ribeiro, F.S, Lima, L.M.T.R.
登録日2022-06-07
公開日2023-05-10
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Linking B-factor and temperature-induced conformational transition.
Biophys.Chem., 298, 2023
5D5R
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BU of 5d5r by Molmil
Horse-heart myoglobin - deoxy state
分子名称: Myoglobin, PROTOPORPHYRIN IX CONTAINING FE
著者Barends, T, Schlichting, I.
登録日2015-08-11
公開日2015-09-16
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Direct observation of ultrafast collective motions in CO myoglobin upon ligand dissociation.
Science, 350, 2015
3P5F
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BU of 3p5f by Molmil
Structure of the carbohydrate-recognition domain of human Langerin with man2 (Man alpha1-2 Man)
分子名称: C-type lectin domain family 4 member K, CALCIUM ION, alpha-D-mannopyranose, ...
著者Feinberg, H, Taylor, M.E, Razi, N, McBride, R, Knirel, Y.A, Graham, S.A, Drickamer, K, Weis, W.I.
登録日2010-10-08
公開日2010-12-08
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (1.7501 Å)
主引用文献Structural Basis for Langerin Recognition of Diverse Pathogen and Mammalian Glycans through a Single Binding Site.
J.Mol.Biol., 405, 2011

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