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3UVE
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BU of 3uve by Molmil
Crystal structure of Carveol dehydrogenase ((+)-trans-carveol dehydrogenase) from Mycobacterium avium
分子名称: 1,2-ETHANEDIOL, Carveol dehydrogenase ((+)-trans-carveol dehydrogenase), NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ...
著者Seattle Structural Genomics Center for Infectious Disease (SSGCID)
登録日2011-11-29
公開日2011-12-14
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Increasing the structural coverage of tuberculosis drug targets.
Tuberculosis (Edinb), 95, 2015
3CSE
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BU of 3cse by Molmil
Candida glabrata Dihydrofolate Reductase complexed with NADPH and 2,4-diamino-5-(3-(2,5-dimethoxyphenyl)prop-1-ynyl)-6-ethylpyrimidine (UCP120B)
分子名称: 5-[3-(2,5-dimethoxyphenyl)prop-1-yn-1-yl]-6-ethylpyrimidine-2,4-diamine, Dihydrofolate reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
著者Liu, J, Anderson, A.C.
登録日2008-04-09
公開日2008-11-25
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Structure-guided development of efficacious antifungal agents targeting Candida glabrata dihydrofolate reductase.
Chem.Biol., 15, 2008
4TU5
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BU of 4tu5 by Molmil
Staphylococcus aureus Dihydrofolate Reductase complexed with NADPH and 6-ETHYL-5-[(3S)-3-[3-METHOXY-5-(PYRIDIN-4-YL)PHENYL]BUT-1-YN-1-YL]PYRIMIDINE-2,4-DIAMINE (UCP1062)
分子名称: 6-ethyl-5-{(3S)-3-[3-methoxy-5-(pyridin-4-yl)phenyl]but-1-yn-1-yl}pyrimidine-2,4-diamine, Dihydrofolate reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
著者Reeve, S.M, Anderson, A.C.
登録日2014-06-23
公開日2015-07-08
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.161 Å)
主引用文献Nonracemic Antifolates Stereoselectively Recruit Alternate Cofactors and Overcome Resistance in S. aureus.
J.Am.Chem.Soc., 137, 2015
2G5W
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BU of 2g5w by Molmil
X-ray crystal structure of Arabidopsis thaliana 12-oxophytodienoate reductase isoform 3 (AtOPR3) in complex with 8-iso prostaglandin A1 and its cofactor, flavin mononucleotide.
分子名称: (8S,12S)-15S-HYDROXY-9-OXOPROSTA-10Z,13E-DIEN-1-OIC ACID, 12-oxophytodienoate reductase 3, FLAVIN MONONUCLEOTIDE
著者Han, B.W, Malone, T.E, Bingman, C.A, Wesenberg, G.E, Phillips Jr, G.N, Fox, B.G, Center for Eukaryotic Structural Genomics (CESG)
登録日2006-02-23
公開日2006-04-04
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.576 Å)
主引用文献Crystal structure of Arabidopsis thaliana 12-oxophytodienoate reductase isoform 3 in complex with 8-iso prostaglandin A(1).
Proteins, 79, 2011
6MUB
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BU of 6mub by Molmil
Anti-HIV-1 Fab 2G12 + Man5 re-refinement
分子名称: Fab 2G12, heavy chain, light chain, ...
著者Wilson, I.A, Calarese, D.A, Stanfield, R.L.
登録日2018-10-22
公開日2018-10-31
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (2.503 Å)
主引用文献Dissection of the carbohydrate specificity of the broadly neutralizing anti-HIV-1 antibody 2G12.
Proc.Natl.Acad.Sci.USA, 102, 2005
1GLQ
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BU of 1glq by Molmil
1.8 ANGSTROMS MOLECULAR STRUCTURE OF MOUSE LIVER CLASS PI GLUTATHIONE S-TRANSFERASE COMPLEXED WITH S-(P-NITROBENZYL)GLUTATHIONE AND OTHER INHIBITORS
分子名称: GLUTATHIONE S-TRANSFERASE YFYF, S-(P-NITROBENZYL)GLUTATHIONE
著者Garcia-Saez, I, Coll, M.
登録日1994-03-07
公開日1994-05-31
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Molecular structure at 1.8 A of mouse liver class pi glutathione S-transferase complexed with S-(p-nitrobenzyl)glutathione and other inhibitors.
J.Mol.Biol., 237, 1994
1XVW
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BU of 1xvw by Molmil
Crystal Structure of AhpE from Mycobacterium tuberculosis, a 1-Cys peroxiredoxin
分子名称: Hypothetical protein Rv2238c/MT2298
著者Li, S, Peterson, N.A, Kim, M.Y, Kim, C.Y, Hung, L.W, Yu, M, Lekin, T, Segelke, B.W, Lott, J.S, Baker, E.N, TB Structural Genomics Consortium (TBSGC)
登録日2004-10-28
公開日2005-02-22
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Crystal Structure of AhpE from Mycobacterium tuberculosis, a 1-Cys Peroxiredoxin
J.Mol.Biol., 346, 2005
1QXS
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BU of 1qxs by Molmil
CRYSTAL STRUCTURE OF Trypanosoma cruzi GLYCERALDEHYDE-3- PHOSPHATE DEHYDROGENASE COMPLEXED WITH AN ANALOGUE OF 1,3- BisPHOSPHO-D-GLYCERIC ACID
分子名称: 3-HYDROXY-2-OXO-4-PHOPHONOXY- BUTYL)-PHOSPHONIC ACID, Glyceraldehyde 3-phosphate dehydrogenase, glycosomal, ...
著者Castilho, M.S, Pavao, F, Oliva, G.
登録日2003-09-08
公開日2004-05-11
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.75 Å)
主引用文献Crystal structure of Trypanosoma cruzi glyceraldehyde-3-phosphate dehydrogenase complexed with an analogue of 1,3-bisphospho-d-glyceric acid.
Eur.J.Biochem., 270, 2003
6B1O
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BU of 6b1o by Molmil
The structure of DPP4 in complex with Vildagliptin Analog
分子名称: (2S)-2-amino-1-[(1S,3S,5S)-3-(aminomethyl)-2-azabicyclo[3.1.0]hexan-2-yl]-2-[(1r,3R,5S,7S)-3,5-dihydroxytricyclo[3.3.1.1~3,7~]decan-1-yl]ethan-1-one, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Scapin, G.
登録日2017-09-18
公開日2017-09-27
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (1.91 Å)
主引用文献A comparative study of the binding properties, dipeptidyl peptidase-4 (DPP-4) inhibitory activity and glucose-lowering efficacy of the DPP-4 inhibitors alogliptin, linagliptin, saxagliptin, sitagliptin and vildagliptin in mice.
Endocrinol Diabetes Metab, 1, 2018
3AK1
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BU of 3ak1 by Molmil
Superoxide dismutase from Aeropyrum pernix K1, apo-form
分子名称: 1,2-ETHANEDIOL, Superoxide dismutase [Mn/Fe]
著者Nakamura, T, Uegaki, K.
登録日2010-06-30
公開日2011-02-02
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.57 Å)
主引用文献Crystal structure of the cambialistic superoxide dismutase from Aeropyrum pernix K1 - insights into the enzyme mechanism and stability
Febs J., 278, 2011
5F1A
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BU of 5f1a by Molmil
The Crystal Structure of Salicylate Bound to Human Cyclooxygenase-2
分子名称: 1,2-ETHANEDIOL, 2-HYDROXYBENZOIC ACID, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Lucido, M.J, Orlando, B.J, Malkowski, M.G.
登録日2015-11-30
公開日2016-03-16
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (2.38 Å)
主引用文献Crystal Structure of Aspirin-Acetylated Human Cyclooxygenase-2: Insight into the Formation of Products with Reversed Stereochemistry.
Biochemistry, 55, 2016
5SUX
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BU of 5sux by Molmil
Crystal Structure of ToxT from Vibrio Cholerae O395 bound to (E)-4-(8-methylnaphthalen-1-yl)but-3-enoic acid
分子名称: (3E)-4-(8-methylnaphthalen-1-yl)but-3-enoic acid, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, AraC family transcriptional regulator
著者Kull, F.J, Kelley, A.R.
登録日2016-08-04
公開日2017-04-12
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Crystal Structure of ToxT from Vibrio Cholerae O395 bound to (E)-4-(8-methylnaphthalen-1-yl)but-3-enoic acid
To Be Published
1XXU
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BU of 1xxu by Molmil
Crystal Structure of AhpE from Mycrobacterium tuberculosis, a 1-Cys peroxiredoxin
分子名称: Hypothetical protein Rv2238c/MT2298
著者Li, S, Peterson, N.A, Kim, M.Y, Kim, C.Y, Hung, L.W, Yu, M, Lekin, T, Segelke, B.W, Lott, J.S, Baker, E.N, TB Structural Genomics Consortium (TBSGC)
登録日2004-11-08
公開日2005-02-22
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Crystal Structure of AhpE from Mycobacterium tuberculosis, a 1-Cys Peroxiredoxin
J.Mol.Biol., 346, 2005
2H7R
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BU of 2h7r by Molmil
L244A mutant of Cytochrome P450cam complexed with imidazole
分子名称: 1-METHYLIMIDAZOLE, Cytochrome P450-cam, PROTOPORPHYRIN IX CONTAINING FE
著者Verras, A, Alian, A, Montellano, P.R.
登録日2006-06-02
公開日2006-10-31
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Cytochrome P450 active site plasticity: attenuation of imidazole binding in cytochrome P450cam by an L244A mutation.
Protein Eng.Des.Sel., 19, 2006
1GLP
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BU of 1glp by Molmil
1.8 ANGSTROMS MOLECULAR STRUCTURE OF MOUSE LIVER CLASS PI GLUTATHIONE S-TRANSFERASE COMPLEXED WITH S-(P-NITROBENZYL)GLUTATHIONE AND OTHER INHIBITORS
分子名称: GLUTATHIONE S-TRANSFERASE YFYF, GLUTATHIONE SULFONIC ACID
著者Garcia-Saez, I, Coll, M.
登録日1994-03-07
公開日1994-06-22
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Molecular structure at 1.8 A of mouse liver class pi glutathione S-transferase complexed with S-(p-nitrobenzyl)glutathione and other inhibitors.
J.Mol.Biol., 237, 1994
3IS4
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BU of 3is4 by Molmil
Crystal structure of Leishmania mexicana pyruvate kinase (LmPYK)in complex with 1,3,6,8-pyrenetetrasulfonic acid
分子名称: GLYCEROL, Pyruvate kinase, pyrene-1,3,6,8-tetrasulfonic acid
著者Walkinshaw, M.D, Morgan, H.P.
登録日2009-08-25
公開日2010-03-23
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献An improved strategy for the crystallization of Leishmania mexicana pyruvate kinase
Acta Crystallogr.,Sect.F, 66, 2010
3AK3
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BU of 3ak3 by Molmil
Superoxide dismutase from Aeropyrum pernix K1, Fe-bound form
分子名称: 1,2-ETHANEDIOL, FE (III) ION, Superoxide dismutase [Mn/Fe]
著者Nakamura, T, Uegaki, K.
登録日2010-06-30
公開日2011-02-02
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.48 Å)
主引用文献Crystal structure of the cambialistic superoxide dismutase from Aeropyrum pernix K1 - insights into the enzyme mechanism and stability
Febs J., 278, 2011
3BS6
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BU of 3bs6 by Molmil
1.8 Angstrom crystal structure of the periplasmic domain of the membrane insertase YidC
分子名称: 1,2-ETHANEDIOL, CALCIUM ION, Inner membrane protein oxaA, ...
著者Ravaud, S, Sinning, I.
登録日2007-12-22
公開日2008-02-12
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献The Crystal Structure of the Periplasmic Domain of the Escherichia coli Membrane Protein Insertase YidC Contains a Substrate Binding Cleft
J.Biol.Chem., 283, 2008
1U18
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BU of 1u18 by Molmil
1.96 A Crystal structure of H60C mutant of nitrophorin complexed with histamine
分子名称: HISTAMINE, Nitrophorin 1, PHOSPHATE ION, ...
著者Vetter, S.W, Goodin, D.B.
登録日2004-07-15
公開日2005-07-26
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (1.96 Å)
主引用文献1.96 A Crystal structure of H60C mutant of nitrophorin complexed with histamine
TO BE PUBLISHED
3QY1
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BU of 3qy1 by Molmil
1.54A Resolution Crystal Structure of a Beta-Carbonic Anhydrase from Salmonella enterica subsp. enterica serovar Typhimurium str. LT2
分子名称: Carbonic anhydrase, ZINC ION
著者Brunzelle, J.S, Wawrzak, Z, Onopriyenko, O, Anderson, W.F, Savchenko, A, Center for Structural Genomics of Infectious Diseases (CSGID)
登録日2011-03-02
公開日2011-03-16
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.54 Å)
主引用文献1.54A Resolution Crystal Structure of a Beta-Carbonic Anhydrase from Salmonella enterica subsp. enterica serovar Typhimurium str. LT2
To be Published
2JBV
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BU of 2jbv by Molmil
Crystal structure of choline oxidase reveals insights into the catalytic mechanism
分子名称: CHOLINE OXIDASE, DIMETHYL SULFOXIDE, UNKNOWN ATOM OR ION, ...
著者Lountos, G.T, Fan, F, Gadda, G, Orville, A.M.
登録日2006-12-13
公開日2007-12-25
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (1.86 Å)
主引用文献Role of Glu312 in Binding and Positioning of the Substrate for the Hydride Transfer Reaction in Choline Oxidase.
Biochemistry, 47, 2008
3AK2
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BU of 3ak2 by Molmil
Superoxide dismutase from Aeropyrum pernix K1, Mn-bound form
分子名称: 1,2-ETHANEDIOL, MANGANESE (II) ION, Superoxide dismutase [Mn/Fe]
著者Nakamura, T, Uegaki, K.
登録日2010-06-30
公開日2011-02-02
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献Crystal structure of the cambialistic superoxide dismutase from Aeropyrum pernix K1 - insights into the enzyme mechanism and stability
Febs J., 278, 2011
1Z5Y
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BU of 1z5y by Molmil
Crystal Structure Of The Disulfide-Linked Complex Between The N-Terminal Domain Of The Electron Transfer Catalyst DsbD and The Cytochrome c Biogenesis Protein CcmG
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Thiol:disulfide interchange protein dsbD, ...
著者Stirnimann, C.U, Rozhkova, A, Grauschopf, U, Gruetter, M.G, Glockshuber, R, Capitani, G.
登録日2005-03-21
公開日2005-07-19
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (1.94 Å)
主引用文献Structural Basis and Kinetics of DsbD-Dependent Cytochrome c Maturation
STRUCTURE, 13, 2005
3FPL
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BU of 3fpl by Molmil
Chimera of alcohol dehydrogenase by exchange of the cofactor binding domain res 153-295 of C. beijerinckii ADH by T. brockii ADH
分子名称: 1,2-ETHANEDIOL, CACODYLATE ION, CHLORIDE ION, ...
著者Felix, F, Goihberg, E, Shimon, L, Burstein, Y.
登録日2009-01-05
公開日2010-01-19
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Biochemical and structural properties of chimeras constructed by exchange of cofactor-binding domains in alcohol dehydrogenases from thermophilic and mesophilic microorganisms
Biochemistry, 49, 2010
1ZGK
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BU of 1zgk by Molmil
1.35 angstrom structure of the Kelch domain of Keap1
分子名称: Kelch-like ECH-associated protein 1
著者Li, X, Bottoms, C.A, Hannink, M, Beamer, L.J.
登録日2005-04-21
公開日2005-10-04
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献Conserved solvent and side-chain interactions in the 1.35 Angstrom structure of the Kelch domain of Keap1.
Acta Crystallogr.,Sect.D, 61, 2005

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