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1QK4
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BU of 1qk4 by Molmil
TOXOPLASMA GONDII HYPOXANTHINE-GUANINE PHOSPHORIBOSYLTRANSFERASE IMP COMPLEX
分子名称: HYPOXANTHINE-GUANINE PHOSPHORIBOSYLTRANSFERASE, INOSINIC ACID
著者Heroux, A, White, E.L, Ross, L.J, Borhani, D.W.
登録日1999-07-09
公開日1999-10-17
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Crystal Structures of the Toxoplasma Gondii Hypoxanthine-Guanine Phosphoribosyltransferase Gmp and -Imp Complexes: Comparison of Purine Binding Interactions with the Xmp Complex
Biochemistry, 38, 1999
3TLM
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BU of 3tlm by Molmil
Crystal Structure of Endoplasmic Reticulum Ca2+-ATPase (SERCA) From Bovine Muscle
分子名称: CALCIUM ION, MAGNESIUM ION, PHOSPHOMETHYLPHOSPHONIC ACID ADENYLATE ESTER, ...
著者Sacchetto, R, Bertipaglia, I, Giannetti, S, Cendron, L, Mascarello, F, Damiani, E, Carafoli, E, Zanotti, G.
登録日2011-08-30
公開日2012-03-21
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.95 Å)
主引用文献Crystal structure of sarcoplasmic reticulum Ca(2+)-ATPase (SERCA) from bovine muscle.
J.Struct.Biol., 178, 2012
6J4A
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BU of 6j4a by Molmil
Human H chain ferritin with an extension peptide
分子名称: Ferritin heavy chain
著者Zhang, X, Zang, J, Zhou, K, Zhao, G.
登録日2019-01-08
公開日2019-09-18
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (3.99 Å)
主引用文献Thermostability of protein nanocages: the effect of natural extra peptide on the exterior surface
Rsc Adv, 9, 2019
2DDC
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BU of 2ddc by Molmil
Unique behavior of a histidine responsible for an engineered green-to-red photoconversion process
分子名称: MAGNESIUM ION, SODIUM ION, photoconvertible fluorescent protein
著者Shimizu, H, Tsutsui, H, Nukina, N, Miyawaki, A.
登録日2006-01-27
公開日2006-03-07
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献The E1 mechanism in photo-induced beta-elimination reactions for green-to-red conversion of fluorescent proteins.
Chem.Biol., 16, 2009
3KS3
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BU of 3ks3 by Molmil
High resolution structure of Human Carbonic Anhydrase II at 0.9 A
分子名称: Carbonic anhydrase 2, GLYCEROL, ZINC ION
著者Avvaru, B.S.
登録日2009-11-20
公開日2010-01-26
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (0.9 Å)
主引用文献A short, strong hydrogen bond in the active site of human carbonic anhydrase II.
Biochemistry, 49, 2010
3TOB
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BU of 3tob by Molmil
Human MOF E350Q crystal structure with active site lysine partially acetylated
分子名称: CHLORIDE ION, ZINC ION, histone acetyltransferase MYST1
著者Yuan, H, Ding, E.C, Marmorstein, R.
登録日2011-09-04
公開日2011-11-09
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (2.703 Å)
主引用文献MYST protein acetyltransferase activity requires active site lysine autoacetylation.
Embo J., 31, 2011
4IAP
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BU of 4iap by Molmil
Crystal structure of PH domain of Osh3 from Saccharomyces cerevisiae
分子名称: Oxysterol-binding protein homolog 3,Endolysin,Oxysterol-binding protein homolog 3, SULFATE ION
著者Tong, J, Im, Y.J.
登録日2012-12-07
公開日2013-07-31
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Structure of osh3 reveals a conserved mode of phosphoinositide binding in oxysterol-binding proteins
Structure, 21, 2013
4IB1
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BU of 4ib1 by Molmil
Structure of cAMP dependent protein kinase A in complex with high K+ concentration, ADP and phosphorylated peptide pSP20
分子名称: ADENOSINE-5'-DIPHOSPHATE, POTASSIUM ION, cAMP-dependent protein kinase catalytic subunit alpha, ...
著者Gerlits, O, Kovalevsky, A.
登録日2012-12-07
公開日2013-12-11
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (1.63 Å)
主引用文献Metal-Free cAMP-Dependent Protein Kinase Can Catalyze Phosphoryl Transfer.
Biochemistry, 53, 2014
1QGH
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BU of 1qgh by Molmil
THE X-RAY STRUCTURE OF THE UNUSUAL DODECAMERIC FERRITIN FROM LISTERIA INNOCUA, REVEALS A NOVEL INTERSUBUNIT IRON BINDING SITE.
分子名称: FE (III) ION, NON-HEME IRON-CONTAINING FERRITIN
著者Ilari, A, Stefanini, S, Chiancone, E, Tsernoglou, D.
登録日1999-04-27
公開日2000-01-14
最終更新日2023-08-16
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献The dodecameric ferritin from Listeria innocua contains a novel intersubunit iron-binding site.
Nat.Struct.Biol., 7, 2000
6TVX
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BU of 6tvx by Molmil
Human CD73 (ecto 5'-nucleotidase) in complex with PSB12676 (an AOPCP derivative, compound 9 in paper) in the closed state
分子名称: 5'-nucleotidase, ZINC ION, [[(2~{R},3~{S},4~{R},5~{R})-5-[2,6-bis(azanyl)purin-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]methylphosphonic acid
著者Pippel, J, Strater, N.
登録日2020-01-10
公開日2020-02-19
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献2-Substituted alpha , beta-Methylene-ADP Derivatives: Potent Competitive Ecto-5'-nucleotidase (CD73) Inhibitors with Variable Binding Modes.
J.Med.Chem., 63, 2020
3OKT
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BU of 3okt by Molmil
Mouse Plexin A2, extracellular domains 1-4
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, CHLORIDE ION, GLYCEROL, ...
著者Janssen, B.J.C, Robinson, R.A, Bell, C.H, Siebold, C, Jones, E.Y.
登録日2010-08-25
公開日2010-10-13
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (2.296 Å)
主引用文献Structural basis of semaphorin-plexin signalling.
Nature, 467, 2010
3HKZ
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BU of 3hkz by Molmil
The X-ray crystal structure of RNA polymerase from Archaea
分子名称: DNA-directed RNA polymerase subunit 13, DNA-directed RNA polymerase subunit A', DNA-directed RNA polymerase subunit A'', ...
著者Murakami, K.S.
登録日2009-05-26
公開日2009-06-09
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (3.4 Å)
主引用文献The X-ray crystal structure of RNA polymerase from Archaea.
Nature, 451, 2008
6R0J
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BU of 6r0j by Molmil
The N-terminal domain of rhomboid protease YqgP
分子名称: Rhomboid family serine protease
著者Began, J, Strisovsky, K, Veverka, V.
登録日2019-03-13
公開日2020-01-08
最終更新日2024-06-19
実験手法SOLUTION NMR
主引用文献Rhomboid intramembrane protease YqgP licenses bacterial membrane protein quality control as adaptor of FtsH AAA protease.
Embo J., 39, 2020
1GPX
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BU of 1gpx by Molmil
C85S GAPDX, NMR, 20 STRUCTURES
分子名称: GALLIUM (III) ION, PUTIDAREDOXIN
著者Pochapsky, T.C, Kuti, M, Kazanis, S.
登録日1998-06-10
公開日1999-01-27
最終更新日2024-05-01
実験手法SOLUTION NMR
主引用文献The solution structure of a gallium-substituted putidaredoxin mutant: GaPdx C85S.
J.Biomol.NMR, 12, 1998
3P6G
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BU of 3p6g by Molmil
Human adipocyte lipid-binding protein FABP4 in complex with (R)-ibuprofen
分子名称: (2R)-2-[4-(2-methylpropyl)phenyl]propanoic acid, Fatty acid-binding protein, adipocyte
著者Gonzalez, J.M, Pozharski, E.
登録日2010-10-11
公開日2011-04-13
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.2 Å)
主引用文献Structural analysis of ibuprofen binding to human adipocyte fatty-acid binding protein (FABP4).
Acta Crystallogr F Struct Biol Commun, 71, 2015
6RFH
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BU of 6rfh by Molmil
Human Carbonic Anhydrase II in complex with 4-Carboxybenzenesulfonamide
分子名称: (4-CARBOXYPHENYL)(CHLORO)MERCURY, 4-sulfamoylbenzoic acid, Carbonic anhydrase 2, ...
著者Gloeckner, S, Heine, A, Klebe, G.
登録日2019-04-15
公開日2020-05-13
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (0.969 Å)
主引用文献Human Carbonic Anhydrase II in complex with 4-Carboxybenzenesulfonamide
To Be Published
6U6B
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BU of 6u6b by Molmil
Structure of human DNA polymerase beta misinserting dAMPNPP opposite the 5'G of the cisplatin Pt-GG intrastrand crosslink with Manganese in the active site
分子名称: 2'-deoxy-5'-O-[(R)-hydroxy{[(R)-hydroxy(phosphonooxy)phosphoryl]amino}phosphoryl]adenosine, Cisplatin, DNA (5'-D(*CP*CP*CP*AP*CP*GP*GP*CP*CP*CP*AP*TP*CP*AP*CP*C)-3'), ...
著者Ouzon-Shubeita, H, Vilas, C.K, Lee, S.
登録日2019-08-29
公開日2020-09-09
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (3.108 Å)
主引用文献Structural insights into the promutagenic bypass of the major cisplatin-induced DNA lesion.
Biochem.J., 477, 2020
2DUZ
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BU of 2duz by Molmil
Human Aldose Reductase complexed with inhibitor zopolrestat after 3 days soaking (3days_soaked_2)
分子名称: 3,4-DIHYDRO-4-OXO-3-((5-TRIFLUOROMETHYL-2-BENZOTHIAZOLYL)METHYL)-1-PHTHALAZINE ACETIC ACID, Aldose reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
著者Steuber, H, Heine, A, Klebe, G.
登録日2006-07-27
公開日2006-10-03
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Expect the Unexpected or Caveat for Drug Designers: Multiple Structure Determinations Using Aldose Reductase Crystals Treated under Varying Soaking and Co-crystallisation Conditions
J.Mol.Biol., 363, 2006
8E34
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BU of 8e34 by Molmil
CryoEM structures of bAE1 captured in multiple states
分子名称: Anion exchange protein
著者Zhekova, H.R, Wang, W.G, Jiang, J.S, Tsirulnikov, K, Muhammad-Khan, G.H, Azimov, R, Abuladze, N, Kao, L, Newman, D, Noskov, S.Y, Tieleman, P, Zhou, Z.H, Pushkin, A, Kurtz, I.
登録日2022-08-16
公開日2023-01-25
最終更新日2024-06-12
実験手法ELECTRON MICROSCOPY (6 Å)
主引用文献CryoEM structures of anion exchanger 1 capture multiple states of inward- and outward-facing conformations.
Commun Biol, 5, 2022
6U3X
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BU of 6u3x by Molmil
PCSK9 in complex with compound 2
分子名称: 2-[(1R)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl]-N-(1,3-thiazol-2-yl)acetamide, Proprotein convertase subtilisin/kexin type 9
著者Lu, J, Soisson, S.
登録日2019-08-22
公開日2019-11-06
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (2.64 Å)
主引用文献From Screening to Targeted Degradation: Strategies for the Discovery and Optimization of Small Molecule Ligands for PCSK9.
Cell Chem Biol, 27, 2020
4IAD
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BU of 4iad by Molmil
Low temperature X-ray Structure OF cAMP dependent protein kinase A in complex with high Mg2+ concentration, ADP and phosphorylated peptide pSP20
分子名称: ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, Phosphorylated peptide pSP20, ...
著者Gerlits, O, Kovalevsky, A.
登録日2012-12-06
公開日2013-06-12
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Insights into the Phosphoryl Transfer Catalyzed by cAMP-Dependent Protein Kinase: An X-ray Crystallographic Study of Complexes with Various Metals and Peptide Substrate SP20.
Biochemistry, 52, 2013
6RHK
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BU of 6rhk by Molmil
The crystal structure of human carbonic anhydrase II in complex with 4-(3-benzylimidazolidine-1-carbonyl)benzenesulfonamide
分子名称: 4-[3-(phenylmethyl)imidazolidin-1-yl]carbonylbenzenesulfonamide, Carbonic anhydrase 2, GLYCEROL, ...
著者Ferraroni, M, Angeli, A, Supuran, C.T.
登録日2019-04-22
公開日2020-05-13
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.44 Å)
主引用文献Sulfonamides incorporating piperazine bioisosteres as potent human carbonic anhydrase I, II, IV and IX inhibitors.
Bioorg.Chem., 91, 2019
4IAZ
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BU of 4iaz by Molmil
Structure of cAMP dependent protein kinase A in complex with high Ba2+ concentration, ADP and phosphorylated peptide pSP20
分子名称: ADENOSINE-5'-DIPHOSPHATE, BARIUM ION, cAMP-dependent protein kinase catalytic subunit alpha, ...
著者Gerlits, O, Kovalevsky, A.
登録日2012-12-07
公開日2013-06-12
最終更新日2024-11-27
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Insights into the Phosphoryl Transfer Catalyzed by cAMP-Dependent Protein Kinase: An X-ray Crystallographic Study of Complexes with Various Metals and Peptide Substrate SP20.
Biochemistry, 52, 2013
2DR0
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BU of 2dr0 by Molmil
Crystal structure of human carboxylesterase in complex with taurocholate
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Liver carboxylesterase 1, N-acetyl-alpha-neuraminic acid, ...
著者Bencharit, S, Redinbo, M.R.
登録日2006-06-02
公開日2006-08-29
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献Multisite promiscuity in the processing of endogenous substrates by human carboxylesterase 1
J.Mol.Biol., 363, 2006
1H9Z
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Human Serum Albumin Complexed With Myristic Acid and the R-(+) enantiomer of warfarin
分子名称: MYRISTIC ACID, R-WARFARIN, SERUM ALBUMIN
著者Petitpas, I, Bhattacharya, A.A, Curry, S.
登録日2001-03-23
公開日2001-06-20
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Crystal Structure Analysis of Warfarin Binding to Human Serum Albumin: Anatomy of Drug Site I
J.Biol.Chem., 276, 2001

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