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1H2A
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BU of 1h2a by Molmil
SINGLE CRYSTALS OF HYDROGENASE FROM DESULFOVIBRIO VULGARIS
分子名称: FE3-S4 CLUSTER, HYDROGENASE, IRON/SULFUR CLUSTER, ...
著者Higuchi, Y, Yasuoka, N.
登録日1997-10-17
公開日1999-02-09
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Unusual ligand structure in Ni-Fe active center and an additional Mg site in hydrogenase revealed by high resolution X-ray structure analysis.
Structure, 5, 1997
7E3H
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BU of 7e3h by Molmil
Crystal structure of human acetylcholinesterase in complex with donepezil
分子名称: 1-BENZYL-4-[(5,6-DIMETHOXY-1-INDANON-2-YL)METHYL]PIPERIDINE, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, Acetylcholinesterase
著者Dileep, K.V, Ihara, K, Mishima-Tsumagari, C, Kukimoto-Niino, M, Yonemochi, M, Hanada, K, Shirouzu, M, Zhang, K.Y.J.
登録日2021-02-08
公開日2022-02-16
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.45 Å)
主引用文献Crystal structure of human acetylcholinesterase in complex with tacrine: Implications for drug discovery
Int.J.Biol.Macromol., 210, 2022
1GRB
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BU of 1grb by Molmil
SUBSTRATE BINDING AND CATALYSIS BY GLUTATHIONE REDUCTASE AS DERIVED FROM REFINED ENZYME: SUBSTRATE CRYSTAL STRUCTURES AT 2 ANGSTROMS RESOLUTION
分子名称: FLAVIN-ADENINE DINUCLEOTIDE, GLUTATHIONE REDUCTASE, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
著者Karplus, P.A, Schulz, G.E.
登録日1992-12-15
公開日1994-01-31
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Substrate binding and catalysis by glutathione reductase as derived from refined enzyme: substrate crystal structures at 2 A resolution.
J.Mol.Biol., 210, 1989
1BMR
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BU of 1bmr by Molmil
ALPHA-LIKE TOXIN LQH III FROM SCORPION LEIURUS QUINQUESTRIATUS HEBRAEUS, NMR, 25 STRUCTURES
分子名称: LQH III ALPHA-LIKE TOXIN
著者Krimm, I, Gilles, N, Sautiere, P, Stankiewicz, M, Pelhate, M, Gordon, D, Lancelin, J.-M.
登録日1998-07-24
公開日1999-02-16
最終更新日2022-02-16
実験手法SOLUTION NMR
主引用文献NMR structures and activity of a novel alpha-like toxin from the scorpion Leiurus quinquestriatus hebraeus.
J.Mol.Biol., 285, 1999
2L7J
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BU of 2l7j by Molmil
Solution structure of the third Immunoglobulin-like domain of nectin-1
分子名称: Poliovirus receptor-related 1
著者Clausen, O, Poulsen, F.M.
登録日2010-12-13
公開日2011-12-14
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献Solution structure of the third Immunoglobulin-like domain of nectin-1
To be Published
6V8Q
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BU of 6v8q by Molmil
Structure of an inner membrane protein required for PhoPQ regulated increases in outer membrane cardiolipin
分子名称: (9Z,21R,24R,30R,33R,44Z)-24,27,30-trihydroxy-18,24,30,36-tetraoxo-19,23,25,29,31,35-hexaoxa-24lambda~5~,30lambda~5~-dip hosphatripentaconta-9,44-diene-21,33-diyl (9Z,9'Z)di-octadec-9-enoate, CALCIUM ION, DODECYL-BETA-D-MALTOSIDE, ...
著者Fan, J, Miller, S.
登録日2019-12-11
公開日2020-03-18
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.699585 Å)
主引用文献Structure of an Inner Membrane Protein Required for PhoPQ-Regulated Increases in Outer Membrane Cardiolipin.
Mbio, 11, 2020
7E73
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BU of 7e73 by Molmil
Crystal structure of human ERK2 mutant (Y36H)
分子名称: Mitogen-activated protein kinase 1, SULFATE ION
著者Park, Y.S, Kim, M, Ryu, S.E.
登録日2021-02-25
公開日2022-03-02
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.28 Å)
主引用文献Structural mechanism of inhibitor-resistance by ERK2 mutations
Biodesign, 9, 2021
7E75
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BU of 7e75 by Molmil
Crystal structure of human ERK2 mutant (G37C)
分子名称: Mitogen-activated protein kinase 1
著者Park, Y.S, Kim, M, Ryu, S.E.
登録日2021-02-25
公開日2022-03-02
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.481 Å)
主引用文献Structural mechanism of inhibitor-resistance by ERK2 mutations
Biodesign, 9, 2021
1I7K
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BU of 1i7k by Molmil
CRYSTAL STRUCTURE OF HUMAN MITOTIC-SPECIFIC UBIQUITIN-CONJUGATING ENZYME, UBCH10
分子名称: UBIQUITIN-CONJUGATING ENZYME E2 H10
著者Basavappa, R, Lin, Y.
登録日2001-03-09
公開日2001-04-04
最終更新日2023-08-09
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Structural and functional analysis of the human mitotic-specific ubiquitin-conjugating enzyme, UbcH10.
J.Biol.Chem., 277, 2002
6USX
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BU of 6usx by Molmil
Identification of the Clinical Development Candidate MRTX849, a Covalent KRASG12C Inhibitor for the Treatment of Cancer
分子名称: 1-{4-[2-{[(2S)-1-methylpyrrolidin-2-yl]methoxy}-7-(naphthalen-1-yl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl}propan-1-one, GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, ...
著者Vigers, G.P, Smith, D.J.
登録日2019-10-28
公開日2020-04-22
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.27 Å)
主引用文献Identification of the Clinical Development CandidateMRTX849, a Covalent KRASG12CInhibitor for the Treatment of Cancer.
J.Med.Chem., 63, 2020
1HRA
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BU of 1hra by Molmil
THE SOLUTION STRUCTURE OF THE HUMAN RETINOIC ACID RECEPTOR-BETA DNA-BINDING DOMAIN
分子名称: RETINOIC ACID RECEPTOR, ZINC ION
著者Knegtel, R.M.A, Katahira, M, Schilthuis, J.G, Bonvin, A.M.J.J, Boelens, R, Eib, D, Van Der Saag, P.T, Kaptein, R.
登録日1993-07-25
公開日1994-01-31
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献The solution structure of the human retinoic acid receptor-beta DNA-binding domain.
J.Biomol.NMR, 3, 1993
2LM2
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BU of 2lm2 by Molmil
NMR structures of the transmembrane domains of the AChR b2 subunit
分子名称: Neuronal acetylcholine receptor subunit beta-2
著者Bondarenko, V, Mowrey, D, Tillman, T, Cui, T, Liu, L.T, Xu, Y, Tang, P.
登録日2011-11-18
公開日2012-03-28
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献NMR structures of the transmembrane domains of the a4b2 nAChR.
Biochim.Biophys.Acta, 1818, 2012
2LC6
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BU of 2lc6 by Molmil
Solution structure of Par-6 Q144C/L164C
分子名称: Par-6
著者Volkman, B.F, Whitney, D.S, Peterson, F.C.
登録日2011-04-25
公開日2011-11-30
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献A Conformational Switch in the CRIB-PDZ Module of Par-6.
Structure, 19, 2011
6UZY
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BU of 6uzy by Molmil
Cryo-EM structure of Xenopus tropicalis pannexin 1
分子名称: HEXADECANE, Pannexin, [(2~{R})-1-[2-azanylethoxy(oxidanyl)phosphoryl]oxy-3-hexadecanoyloxy-propan-2-yl] (~{Z})-octadec-9-enoate
著者Deng, Z, He, Z, Yuan, P.
登録日2019-11-15
公開日2020-04-01
最終更新日2020-04-22
実験手法ELECTRON MICROSCOPY (3.38 Å)
主引用文献Cryo-EM structures of the ATP release channel pannexin 1.
Nat.Struct.Mol.Biol., 27, 2020
6UT0
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BU of 6ut0 by Molmil
Identification of the Clinical Development Candidate MRTX849, a Covalent KRASG12C Inhibitor for the Treatment of Cancer
分子名称: GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
著者Vigers, G.P, Smith, D.J.
登録日2019-10-29
公開日2020-04-22
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.94 Å)
主引用文献Identification of the Clinical Development CandidateMRTX849, a Covalent KRASG12CInhibitor for the Treatment of Cancer.
J.Med.Chem., 63, 2020
7ENQ
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BU of 7enq by Molmil
Crystal structure of human NAMPT in complex with compound NAT
分子名称: 2-(2-~{tert}-butylphenoxy)-~{N}-(4-hydroxyphenyl)ethanamide, Nicotinamide phosphoribosyltransferase, PHOSPHATE ION
著者Wang, G, Wu, C, Liu, M, Yao, H, Li, C, Wang, L, Tang, Y.
登録日2021-04-19
公開日2022-05-04
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.204966 Å)
主引用文献Discovery of small-molecule activators of nicotinamide phosphoribosyltransferase (NAMPT) and their preclinical neuroprotective activity.
Cell Res., 32, 2022
1CKT
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BU of 1ckt by Molmil
CRYSTAL STRUCTURE OF HMG1 DOMAIN A BOUND TO A CISPLATIN-MODIFIED DNA DUPLEX
分子名称: Cisplatin, DNA (5'-D(*CP*CP*(5IU)P*CP*TP*CP*TP*GP*GP*AP*CP*CP*TP*TP*CP*C)-3'), DNA (5'-D(*GP*GP*AP*AP*GP*GP*TP*CP*CP*AP*GP*AP*GP*AP*GP*G)-3'), ...
著者Ohndorf, U.-M, Rould, M.A, Pabo, C.O, Lippard, S.J.
登録日1999-04-23
公開日1999-06-30
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Basis for recognition of cisplatin-modified DNA by high-mobility-group proteins.
Nature, 399, 1999
6VAM
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BU of 6vam by Molmil
Cryo-EM structure of octameric chicken CALHM1
分子名称: Green fluorescent protein,CALHM1 chimera
著者Syrjanen, J.L, Chou, T.H, Furukawa, H.
登録日2019-12-17
公開日2020-01-29
最終更新日2020-11-11
実験手法ELECTRON MICROSCOPY (3.63 Å)
主引用文献Structure and assembly of calcium homeostasis modulator proteins.
Nat.Struct.Mol.Biol., 27, 2020
2LUC
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BU of 2luc by Molmil
Solution Structure of human S100 calcium-binding protein A11
分子名称: Protein S100-A11
著者Hung, K.W, Chang, Y.M, Yu, C.
登録日2012-06-12
公開日2013-05-22
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献NMR structure note: the structure of human calcium-bound S100A11.
J.Biomol.Nmr, 54, 2012
1H1K
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BU of 1h1k by Molmil
THE BLUETONGUE VIRUS (BTV) CORE BINDS DSRNA
分子名称: RNA
著者Diprose, J.M, Grimes, J.M, Sutton, G.C, Burroughs, J.N, Meyer, A, Maan, S, Mertens, P.P.C, Stuart, D.I.
登録日2002-07-17
公開日2002-09-26
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (10 Å)
主引用文献The Core of Bluetongue Virus Binds Double-Stranded RNA
J.Virol., 76, 2002
1BSI
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BU of 1bsi by Molmil
HUMAN PANCREATIC ALPHA-AMYLASE FROM PICHIA PASTORIS, GLYCOSYLATED PROTEIN
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, ALPHA-AMYLASE, CALCIUM ION, ...
著者Rydberg, E.H, Sidhu, G, Vo, H.C, Hewitt, J, Cote, H.C.F, Wang, Y, Numao, S, Macgillivray, R.T.A, Overall, C.M, Brayer, G.D, Withers, S.G.
登録日1998-08-28
公開日1999-05-18
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Cloning, mutagenesis, and structural analysis of human pancreatic alpha-amylase expressed in Pichia pastoris.
Protein Sci., 8, 1999
7EOK
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BU of 7eok by Molmil
Crystal structure of the Pepper aptamer in complex with HBC485
分子名称: 4-[(~{Z})-1-cyano-2-[5-[2-(dimethylamino)ethyl-methyl-amino]pyrazin-2-yl]ethenyl]benzenecarbonitrile, GUANOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, ...
著者Huang, K.Y, Ren, A.M.
登録日2021-04-22
公開日2021-11-24
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Structure-based investigation of fluorogenic Pepper aptamer.
Nat.Chem.Biol., 17, 2021
7EOO
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Crystal structure of the Pepper aptamer in complex with HBC525
分子名称: (~{E})-2-(1,3-benzoxazol-2-yl)-3-[4-[2-hydroxyethyl(methyl)amino]phenyl]prop-2-enenitrile, GUANOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, ...
著者Huang, K.Y, Ren, A.M.
登録日2021-04-22
公開日2021-11-24
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.23 Å)
主引用文献Structure-based investigation of fluorogenic Pepper aptamer.
Nat.Chem.Biol., 17, 2021
7EOP
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Crystal structure of the Pepper aptamer in complex with HBC620
分子名称: 4-[(~{Z})-1-cyano-2-[5-[2-hydroxyethyl(methyl)amino]thieno[3,2-b]thiophen-2-yl]ethenyl]benzenecarbonitrile, GUANOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, ...
著者Huang, K.Y, Ren, A.M.
登録日2021-04-22
公開日2021-11-24
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Structure-based investigation of fluorogenic Pepper aptamer.
Nat.Chem.Biol., 17, 2021
7EOL
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Crystal structure of the Pepper aptamer in complex with HBC497
分子名称: 4-[(~{Z})-1-cyano-2-[5-[2-hydroxyethyl(methyl)amino]pyrazin-2-yl]ethenyl]benzenecarbonitrile, GUANOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, ...
著者Huang, K.Y, Ren, A.M.
登録日2021-04-22
公開日2021-11-24
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.309 Å)
主引用文献Structure-based investigation of fluorogenic Pepper aptamer.
Nat.Chem.Biol., 17, 2021

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