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2CGU
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Identification of chemically diverse Chk1 inhibitors by receptor- based virtual screening
分子名称: 2,2'-{[9-(HYDROXYIMINO)-9H-FLUORENE-2,7-DIYL]BIS(OXY)}DIACETIC ACID, SERINE/THREONINE-PROTEIN KINASE CHK1
著者Foloppe, N, Fisher, L.M, Howes, R, Potter, A, Robertson, A.G.S, Surgenor, A.E.
登録日2006-03-09
公開日2006-04-05
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Identification of Chemically Diverse Chk1 Inhibitors by Receptor-Based Virtual Screening.
Bioorg.Med.Chem., 14, 2006
2RJD
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BU of 2rjd by Molmil
Crystal structure of L3MBTL1 protein
分子名称: Lethal(3)malignant brain tumor-like protein
著者Allali-Hassani, A, Liu, Y, Herzanych, N, Ouyang, H, Mackenzie, F, Crombet, L, Loppnau, P, Kozieradzki, I, Vedadi, M, Weigelt, J, Sundstrom, M, Arrowsmith, C.H, Edwards, A.M, Bochkarev, A, Min, J.R, Structural Genomics Consortium (SGC)
登録日2007-10-14
公開日2007-10-30
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献L3MBTL1 recognition of mono- and dimethylated histones.
Nat.Struct.Mol.Biol., 14, 2007
2CJQ
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BU of 2cjq by Molmil
Bovine viral diarrhea virus CP7-R12 RNA-dependent RNA polymerase
分子名称: RNA-DIRECTED RNA POLYMERASE
著者Choi, K.H, Gallei, A, Becher, P, Rossmann, M.G.
登録日2006-04-05
公開日2006-07-19
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献The Structure of Bovine Viral Diarrhea Virus RNA-Dependent RNA Polymerase and its Amino-Terminal Domain.
Structure, 14, 2006
2CI4
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BU of 2ci4 by Molmil
Crystal Structure of Dimethylarginine dimethylaminohydrolase I crystal form II
分子名称: NG, NG-DIMETHYLARGININE DIMETHYLAMINOHYDROLASE 1
著者Frey, D, Braun, O, Briand, C, Vasak, M, Grutter, M.G.
登録日2006-03-17
公開日2006-05-17
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Structure of the Mammalian Nos Regulator Dimethylarginine Dimethylaminohydrolase: A Basis for the Design of Specific Inhibitors.
Structure, 14, 2006
2CGX
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BU of 2cgx by Molmil
Identification of chemically diverse Chk1 inhibitors by receptor- based virtual screening
分子名称: 2-[(6-AMINO-7H-PURIN-8-YL)THIO]ACETAMIDE, SERINE/THREONINE-PROTEIN KINASE CHK1
著者Foloppe, N, Fisher, L.M, Howes, R, Potter, A, Robertson, A.G.S, Surgenor, A.E.
登録日2006-03-09
公開日2006-04-05
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Identification of Chemically Diverse Chk1 Inhibitors by Receptor-Based Virtual Screening.
Bioorg.Med.Chem., 14, 2006
2CI3
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BU of 2ci3 by Molmil
Crystal Structure of Dimethylarginine dimethylaminohydrolase crystal form I
分子名称: NG, NG-DIMETHYLARGININE DIMETHYLAMINOHYDROLASE 1
著者Frey, D, Braun, O, Briand, C, Vasak, M, Grutter, M.G.
登録日2006-03-17
公開日2006-05-17
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Structure of the Mammalian Nos Regulator Dimethylarginine Dimethylaminohydrolase: A Basis for the Design of Specific Inhibitors.
Structure, 14, 2006
2BZT
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BU of 2bzt by Molmil
NMR structure of the bacterial protein YFHJ from E. coli
分子名称: PROTEIN ISCX
著者Pastore, C, Kelly, G, Adinolfi, S, Mc Cormick, J.E, Pastore, A.
登録日2005-08-22
公開日2006-12-06
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献YfhJ, a molecular adaptor in iron-sulfur cluster formation or a frataxin-like protein?
Structure, 14, 2006
2BIA
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BU of 2bia by Molmil
Radiation damage of the Schiff base in phosphoserine aminotransferase (structure G)
分子名称: CHLORIDE ION, DI(HYDROXYETHYL)ETHER, MAGNESIUM ION, ...
著者Dubnovitsky, A.P, Ravelli, R.B.G, Popov, A.N, Papageorgiou, A.C.
登録日2005-01-20
公開日2005-05-19
最終更新日2019-05-22
実験手法X-RAY DIFFRACTION (1.77 Å)
主引用文献Strain Relief at the Active Site of Phosphoserine Aminotransferase Induced by Radiation Damage.
Protein Sci., 14, 2005
2BZ6
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BU of 2bz6 by Molmil
Orally available Factor7a inhibitor
分子名称: (R)-(4-CARBAMIMIDOYL-PHENYLAMINO)-[5-ETHOXY-2-FLUORO-3-[(R)-TETRAHYDRO-FURAN-3-YLOXY]-PHENYL]-ACETIC ACID, BLOOD COAGULATION FACTOR VIIA, CALCIUM ION, ...
著者Groebke-Zbinden, K, Obst-Sander, U, Hilpert, K, Kuehne, H, Banner, D.W, Boehm, H.J, Stahl, M, Ackermann, J, Alig, L, Weber, L, Wessel, H.P, Riederer, M.A, Tschopp, T.B, Lave, T.
登録日2005-08-11
公開日2006-02-22
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Dose-Dependant Antithrombotic Activity of an Orally Active Tissue Factor/Factor Viia Inhibitor without Concomitant Enhancement of Bleeding Propensity.
Bioorg.Med.Chem., 14, 2006
2C1B
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BU of 2c1b by Molmil
Structure of cAMP-dependent protein kinase complexed with (4R,2S)-5'-(4-(4-Chlorobenzyloxy)pyrrolidin-2-ylmethanesulfonyl)isoquinoline
分子名称: (4R,2S)-5'-(4-(4-CHLOROBENZYLOXY)PYRROLIDIN-2-YLMETHANESULFONYL)ISOQUINOLINE, CAMP-DEPENDENT PROTEIN KINASE, CAMP-DEPENDENT PROTEIN KINASE INHIBITOR
著者Collins, I, Caldwell, J, Fonseca, T, Donald, A, Bavetsias, V, Hunter, L.J, Garrett, M.D, Rowlands, M.G, Aherne, G.W, Davies, T.G, Berdini, V, Woodhead, S.J, Seavers, L.C.A, Wyatt, P.G, Workman, P, McDonald, E.
登録日2005-09-12
公開日2005-11-02
最終更新日2018-02-28
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structure-based design of isoquinoline-5-sulfonamide inhibitors of protein kinase B.
Bioorg. Med. Chem., 14, 2006
2BCX
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BU of 2bcx by Molmil
Crystal structure of calmodulin in complex with a ryanodine receptor peptide
分子名称: CALCIUM ION, Calmodulin, Ryanodine receptor 1
著者Maximciuc, A.A, Shamoo, Y, MacKenzie, K.R.
登録日2005-10-19
公開日2006-10-31
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Complex of calmodulin with a ryanodine receptor target reveals a novel, flexible binding mode.
Structure, 14, 2006
2BI9
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BU of 2bi9 by Molmil
Radiation damage of the Schiff base in phosphoserine aminotransferase (structure F)
分子名称: CHLORIDE ION, DI(HYDROXYETHYL)ETHER, MAGNESIUM ION, ...
著者Dubnovitsky, A.P, Ravelli, R.B.G, Popov, A.N, Papageorgiou, A.C.
登録日2005-01-20
公開日2005-05-19
最終更新日2019-05-22
実験手法X-RAY DIFFRACTION (1.73 Å)
主引用文献Strain Relief at the Active Site of Phosphoserine Aminotransferase Induced by Radiation Damage.
Protein Sci., 14, 2005
2BX6
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BU of 2bx6 by Molmil
Crystal Structure of the human Retinitis Pigmentosa protein 2 (RP2)
分子名称: SULFATE ION, XRP2 PROTEIN
著者Kuhnel, K, Veltel, S, Schlichting, I, Wittinghofer, A.
登録日2005-07-24
公開日2006-01-18
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Crystal Structure of the Human Retinitis Pigmentosa 2 Protein and its Interaction with Arl3
Structure, 14, 2006
5ZK8
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BU of 5zk8 by Molmil
Crystal structure of M2 muscarinic acetylcholine receptor bound with NMS
分子名称: Muscarinic acetylcholine receptor M2,Redesigned apo-cytochrome b562,Muscarinic acetylcholine receptor M2, N-methyl scopolamine
著者Suno, R, Maeda, S, Yasuda, S, Yamashita, K, Hirata, K, Horita, S, Tawaramoto, M.S, Tsujimoto, H, Murata, T, Kinoshita, M, Yamamoto, M, Kobilka, B.K, Iwata, S, Kobayashi, T.
登録日2018-03-23
公開日2018-11-21
最終更新日2022-03-23
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Structural insights into the subtype-selective antagonist binding to the M2muscarinic receptor
Nat. Chem. Biol., 14, 2018
2RKK
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BU of 2rkk by Molmil
Crystal Structure of S.cerevisiae Vta1 N-terminal domain
分子名称: Vacuolar protein sorting-associated protein VTA1
著者Xiao, J, Xia, H, Zhou, J, Xu, Z.
登録日2007-10-16
公開日2008-01-22
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献Structural basis of vta1 function in the multivesicular body sorting pathway.
Dev.Cell, 14, 2008
5Z3Q
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BU of 5z3q by Molmil
Crystal Structure of a Soluble Fragment of Poliovirus 2C ATPase (2.55 Angstrom)
分子名称: PHOSPHATE ION, PV-2C, ZINC ION
著者Guan, H, Tian, J, Zhang, C, Qin, B, Cui, S.
登録日2018-01-08
公開日2018-09-12
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.545 Å)
主引用文献Crystal structure of a soluble fragment of poliovirus 2CATPase
PLoS Pathog., 14, 2018
2D4Z
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BU of 2d4z by Molmil
Crystal structure of the cytoplasmic domain of the chloride channel ClC-0
分子名称: Chloride channel protein
著者Dutzler, R, Meyer, S.
登録日2005-10-26
公開日2006-02-14
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献Crystal structure of the cytoplasmic domain of the chloride channel ClC-0.
Structure, 14, 2006
5ZB1
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BU of 5zb1 by Molmil
Monomeric crystal structure of orf57 from KSHV
分子名称: ORF57, ZINC ION
著者Gao, Z.Q, Yuan, F, Lan, K, Dong, Y.H.
登録日2018-02-09
公開日2018-08-08
最終更新日2024-03-27
実験手法X-RAY DIFFRACTION (3.061 Å)
主引用文献The crystal structure of KSHV ORF57 reveals dimeric active sites important for protein stability and function.
PLoS Pathog., 14, 2018
2D3M
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BU of 2d3m by Molmil
Pentaketide chromone synthase complexed with coenzyme A
分子名称: COENZYME A, pentaketide chromone synthase
著者Morita, H, Kondo, S, Oguro, S, Noguchi, H, Sugio, S, Abe, I, Kohno, T.
登録日2005-09-29
公開日2006-10-24
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Structural Insight into Chain-Length Control and Product Specificity of Pentaketide Chromone Synthase from Aloe arborescens
Chem.Biol., 14, 2007
2RJC
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BU of 2rjc by Molmil
Crystal structure of L3MBTL1 protein in complex with MES
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, Lethal(3)malignant brain tumor-like protein, SULFATE ION
著者Allali-Hassani, A, Liu, Y, Herzanych, N, Ouyang, H, Mackenzie, F, Crombet, L, Loppnau, P, Kozieradzki, I, Vedadi, M, Weigelt, J, Sundstrom, M, Arrowsmith, C.H, Edwards, A.M, Bochkarev, A, Min, J.R, Structural Genomics Consortium (SGC)
登録日2007-10-14
公開日2007-10-30
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献L3MBTL1 recognition of mono- and dimethylated histones.
Nat.Struct.Mol.Biol., 14, 2007
2D52
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BU of 2d52 by Molmil
Pentaketide chromone synthase (M207G mutant complexed with Coa)
分子名称: COENZYME A, pentaketide chromone synthase
著者Kohno, T, Morita, H.
登録日2005-10-27
公開日2006-11-14
最終更新日2021-11-10
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Structural Insight into Chain-Length Control and Product Specificity of Pentaketide Chromone Synthase from Aloe arborescens
Chem.Biol., 14, 2007
5ZQ1
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BU of 5zq1 by Molmil
Crystal structure of spRlmCD with U1939loop RNA at 3.10 angstrom
分子名称: RNA (5'-R(*AP*AP*AP*(MUM)P*UP*CP*CP*U)-3'), S-ADENOSYL-L-HOMOCYSTEINE, Uncharacterized RNA methyltransferase SP_1029
著者Yu, H.L, Jiang, Y.Y.
登録日2018-04-17
公開日2018-10-24
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献Unveiling the structural features that determine the dual methyltransferase activities of Streptococcus pneumoniae RlmCD
PLoS Pathog., 14, 2018
5YYF
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BU of 5yyf by Molmil
Crystal structure of AF9 YEATS domain in complex with a peptide inhibitor "PHQ-H3(Q5-K9)" modified at K9 with 2-furancarboyl group
分子名称: 2-FUROIC ACID, Peptide inhibitor PHQ-H3(Q5-K9), Protein AF-9, ...
著者Li, Y, Li, H.
登録日2017-12-09
公開日2018-11-07
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.903 Å)
主引用文献Structure-guided development of YEATS domain inhibitors by targeting pi-pi-pi stacking.
Nat. Chem. Biol., 14, 2018
5ZKB
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BU of 5zkb by Molmil
Crystal structure of rationally thermostabilized M2 muscarinic acetylcholine receptor bound with AF-DX 384
分子名称: Muscarinic acetylcholine receptor M2,Apo-cytochrome b562,Muscarinic acetylcholine receptor M2, N-[2-[(2S)-2-[(dipropylamino)methyl]piperidin-1-yl]ethyl]-6-oxidanylidene-5H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxamide
著者Suno, R, Maeda, S, Yasuda, S, Yamashita, K, Hirata, K, Horita, S, Tawaramoto, M.S, Tsujimoto, H, Murata, T, Kinoshita, M, Yamamoto, M, Kobilka, B.K, Iwata, S, Kobayashi, T.
登録日2018-03-23
公開日2018-11-21
最終更新日2022-03-23
実験手法X-RAY DIFFRACTION (2.95 Å)
主引用文献Structural insights into the subtype-selective antagonist binding to the M2muscarinic receptor
Nat. Chem. Biol., 14, 2018
2BF4
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BU of 2bf4 by Molmil
A second FMN-binding site in yeast NADPH-cytochrome P450 reductase suggests a novel mechanism of electron transfer by diflavin reductases.
分子名称: FLAVIN MONONUCLEOTIDE, FLAVIN-ADENINE DINUCLEOTIDE, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
著者Podust, L.M, Lepesheva, G.I, Kim, Y, Yermalitskaya, L.V, Yermalitsky, V.N, Lamb, D.C, Kelly, S.L, Waterman, M.R.
登録日2004-12-03
公開日2006-01-17
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献A Second Fmn-Binding Site in Yeast Nadph-Cytochrome P450 Reductase Suggests a Mechanism of Electron Transfer by Diflavin Reductases.
Structure, 14, 2006

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