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4NXI
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BU of 4nxi by Molmil
Rv2466c Mediates the Activation of TP053 To Kill Replicating and Non-replicating Mycobacterium tuberculosis
分子名称: 1,2-ETHANEDIOL, MAGNESIUM ION, Uncharacterized protein
著者Albesa-Jove, D, Urresti, S, Comino, N, Guerin, M.E.
登録日2013-12-09
公開日2014-10-22
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.698 Å)
主引用文献Rv2466c mediates the activation of TP053 to kill replicating and non-replicating Mycobacterium tuberculosis.
Acs Chem.Biol., 9, 2014
1Z7W
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BU of 1z7w by Molmil
Crystal Structure of O-Acetylserine Sulfhydrylase from Arabidopsis thaliana
分子名称: Cysteine synthase, PYRIDOXAL-5'-PHOSPHATE, SULFATE ION
著者Bonner, E.R, Cahoon, R.E, Knapke, S.M, Jez, J.M.
登録日2005-03-28
公開日2005-09-20
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Molecular Basis of Cysteine Biosynthesis in Plants: STRUCTURAL AND FUNCTIONAL ANALYSIS OF O-ACETYLSERINE SULFHYDRYLASE FROM ARABIDOPSIS THALIANA.
J.Biol.Chem., 280, 2005
3EP6
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BU of 3ep6 by Molmil
Human AdoMetDC D174N mutant complexed with S-Adenosylmethionine methyl ester and no putrescine bound
分子名称: PYRUVIC ACID, S-ADENOSYLMETHIONINE METHYL ESTER, S-adenosylmethionine decarboxylase alpha chain, ...
著者Bale, S, Lopez, M.M, Makhatadze, G.I, Fang, Q, Pegg, A.E, Ealick, S.E.
登録日2008-09-29
公開日2008-12-23
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Structural Basis for Putrescine Activation of Human S-Adenosylmethionine Decarboxylase.
Biochemistry, 47, 2008
6CJ3
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BU of 6cj3 by Molmil
CRYSTAL STRUCTURE OF PROTEIN CITE FROM MYCOBACTERIUM TUBERCULOSIS IN COMPLEX WITH MAGNESIUM AND PYRUVATE
分子名称: ACETATE ION, Citrate lyase subunit beta-like protein, MAGNESIUM ION, ...
著者Fedorov, E.V, Fedorov, A.A, Wang, H, Bonanno, J.B, Carvalho, L, Almo, S.C.
登録日2018-02-26
公開日2018-08-01
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.73 Å)
主引用文献An essential bifunctional enzyme inMycobacterium tuberculosisfor itaconate dissimilation and leucine catabolism.
Proc.Natl.Acad.Sci.USA, 116, 2019
5GK6
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BU of 5gk6 by Molmil
Structure of E.Coli fructose 1,6-bisphosphate aldolase, Citrate bound form
分子名称: CITRIC ACID, DI(HYDROXYETHYL)ETHER, Fructose-bisphosphate aldolase class 2, ...
著者Tran, T.H, Huynh, K.H, Ho, T.H, Kang, L.W.
登録日2016-07-03
公開日2017-07-05
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Structure of E.Coli fructose 1,6-bisphosphate aldolase, Citrate bound form
To Be Published
2CL4
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BU of 2cl4 by Molmil
Ascorbate Peroxidase R172A mutant
分子名称: ASCORBATE PEROXIDASE, PROTOPORPHYRIN IX CONTAINING FE, SODIUM ION, ...
著者Ghamsari, L, MacDonald, I.K, Moody, P.C.E.
登録日2006-04-25
公開日2006-06-06
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Interaction of Ascorbate Peroxidase with Substrates: A Mechanistic and Structural Analysis.
Biochemistry, 45, 2006
2CM3
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BU of 2cm3 by Molmil
Structure of Protein Tyrosine Phosphatase 1B (C2)
分子名称: CALCIUM ION, TYROSINE-PROTEIN PHOSPHATASE NON-RECEPTOR TYPE 1
著者Ala, P.J, Gonneville, L, Hillman, M.C, Becker-Pasha, M, Wei, M, Reid, B.G, Klabe, R, Yue, E.W, Wayland, B, Douty, B, Combs, A.P, Polam, P, Wasserman, Z, Bower, M, Burn, T.C, Hollis, G.F, Wynn, R.
登録日2006-05-04
公開日2006-08-17
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structural Basis for Inhibition of Protein-Tyrosine Phosphatase 1B by Isothiazolidinone Heterocyclic Phosphonate Mimetics.
J.Biol.Chem., 281, 2006
3E65
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BU of 3e65 by Molmil
Murine INOS dimer with HEME, pterin and inhibitor AR-C120011
分子名称: 1-[4-(AMINOMETHYL)BENZOYL]-5'-FLUORO-1'H-SPIRO[PIPERIDINE-4,2'-QUINAZOLIN]-4'-AMINE, 5,6,7,8-TETRAHYDROBIOPTERIN, Nitric oxide synthase, ...
著者Rosenfeld, R.J, Garcin, E.D, Getzoff, E.D.
登録日2008-08-14
公開日2008-10-07
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Anchored plasticity opens doors for selective inhibitor design in nitric oxide synthase.
Nat.Chem.Biol., 4, 2008
5UJD
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BU of 5ujd by Molmil
SbnI from Staphylococcus pseudintermedius
分子名称: FORMIC ACID, Siderophore biosynthesis protein SbnI
著者Murphy, M.E.P, Verstraete, M.M.
登録日2017-01-17
公開日2018-01-24
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献The heme-sensitive regulator SbnI has a bifunctional role in staphyloferrin B production by Staphylococcus aureus .
J.Biol.Chem., 294, 2019
2P7F
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BU of 2p7f by Molmil
The Novel Use of a 2',5'-Phosphodiester Linkage as a Reaction Intermediate at the Active Site of a Small Ribozyme
分子名称: COBALT HEXAMMINE(III), Loop A ribozyme strand, Loop B S-turn strand, ...
著者Torelli, A.T, Krucinska, J, Wedekind, J.E.
登録日2007-03-20
公開日2007-05-22
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献A comparison of vanadate to a 2'-5' linkage at the active site of a small ribozyme suggests a role for water in transition-state stabilization
Rna, 13, 2007
7DNA
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BU of 7dna by Molmil
Photocleavable Fluorescent Protein in green and red form
分子名称: Green-to-red photoconvertible GFP-like protein, PHENYLALANINE AMIDE
著者Wen, Y, Lemieux, J.M.
登録日2020-12-09
公開日2021-01-27
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Photocleavable proteins that undergo fast and efficient dissociation.
Chem Sci, 12, 2021
3EBS
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BU of 3ebs by Molmil
Human Cytochrome P450 2A6 I208S/I300F/G301A/S369G in complex with Phenacetin
分子名称: Cytochrome P450 2A6, N-(4-ethoxyphenyl)acetamide, PROTOPORPHYRIN IX CONTAINING FE
著者DeVore, N.M, Scott, E.E.
登録日2008-08-28
公開日2008-09-23
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献Key residues controlling phenacetin metabolism by human cytochrome P4502A enzymes.
Drug Metab.Dispos., 36, 2008
4BQG
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BU of 4bqg by Molmil
structure of HSP90 with an inhibitor bound
分子名称: 5-(3,4-dichloro-phenoxy)-benzene-1,3-diol, HSP90AA1 PROTEIN
著者Casale, E, Brasca, M.G, Mantegani, S, Amboldi, N, Bindi, S, Caronni, D, Ceccarelli, W, Colombo, N, DePonti, A, Donati, D, Ermoli, A, Fachin, G, Felder, E.R, Ferguson, R.D, Fiorelli, C, Guanci, M, Isacchi, A, Pesenti, E, Polucci, P, Riceputi, L, Sola, F, Visco, C, Zuccotto, F, Fogliatto, G.
登録日2013-05-30
公開日2013-10-23
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Discovery of Nms-E973 as Novel, Selective and Potent Inhibitor of Heat Shock Protein 90 (Hsp90).
Bioorg.Med.Chem., 21, 2013
3E8J
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BU of 3e8j by Molmil
Coproporphyrinogen III oxidase from Leishmania naiffi
分子名称: ACETATE ION, COPROPORPHYRINOGEN III OXIDASE, GLYCEROL
著者Larson, E.T, Merritt, E.A, Medical Structural Genomics of Pathogenic Protozoa (MSGPP)
登録日2008-08-19
公開日2008-09-02
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.27 Å)
主引用文献Structural investigation of a protozoan coproporphyrinogen III oxidase
To be Published
3ED3
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BU of 3ed3 by Molmil
Crystal Structure of the Yeast Dithiol/Disulfide Oxidoreductase Mpd1p
分子名称: 1,2-ETHANEDIOL, ACETATE ION, Protein disulfide-isomerase MPD1
著者Vitu, E, Greenblatt, H.M, Fass, D.
登録日2008-09-02
公開日2008-11-04
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Yeast Mpd1p reveals the structural diversity of the protein disulfide isomerase family
J.Mol.Biol., 384, 2008
7JGJ
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BU of 7jgj by Molmil
IgA1 Protease in complex with neutralizing mAb
分子名称: Immunoglobulin A1 protease, mAB Heavy Chain, mAB Light Chain
著者Eisenmesser, E.Z, Zheng, H.
登録日2020-07-19
公開日2020-12-09
実験手法ELECTRON MICROSCOPY (4.8 Å)
主引用文献Mechanism and inhibition of Streptococcus pneumoniae IgA1 protease
Nat Commun, 11, 2020
7JH7
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BU of 7jh7 by Molmil
cardiac actomyosin complex
分子名称: ADENOSINE-5'-DIPHOSPHATE, Actin, alpha cardiac muscle 1, ...
著者Galkin, V.E, Schroeder, G.F.
登録日2020-07-20
公開日2020-10-28
最終更新日2024-03-06
実験手法ELECTRON MICROSCOPY (3.8 Å)
主引用文献High-Resolution Cryo-EM Structure of the Cardiac Actomyosin Complex.
Structure, 29, 2021
1GM8
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BU of 1gm8 by Molmil
Crystal structures of penicillin acylase enzyme-substrate complexes: Structural insights into the catalytic mechanism
分子名称: CALCIUM ION, N-[(2S,4S,6R)-2-(DIHYDROXYMETHYL)-4-HYDROXY-3,3-DIMETHYL-7-OXO-4LAMBDA~4~-THIA-1-AZABICYCLO[3.2.0]HEPT-6-YL]-2-PHENYLAC ETAMIDE, PENICILLIN G ACYLASE ALPHA SUBUNIT, ...
著者McVey, C.E, Walsh, M.A, Dodson, G.G, Wilson, K.S, Brannigan, J.A.
登録日2001-09-11
公開日2001-11-28
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Crystal Structures of Penicillin Acylase Enzyme- Substrate Complexes: Structural Insights Into the Catalytic Mechanism
J.Mol.Biol., 313, 2001
5GK8
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BU of 5gk8 by Molmil
Structure of E.Coli fructose 1,6-bisphosphate aldolase, Acetate bound form
分子名称: ACETATE ION, DI(HYDROXYETHYL)ETHER, Fructose-bisphosphate aldolase class 2, ...
著者Tran, T.H, Huynh, K.H, Ho, T.H, Kang, L.W.
登録日2016-07-03
公開日2017-07-05
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.002 Å)
主引用文献Structure of E.Coli fructose 1,6-bisphosphate aldolase, Acetate bound form
To Be Published
2GUM
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BU of 2gum by Molmil
Crystal structure of the extracellular domain of glycoprotein B from Herpes Simplex Virus type I
分子名称: Glycoprotein B, SODIUM ION
著者Heldwein, E.E.
登録日2006-05-01
公開日2006-07-25
最終更新日2017-10-18
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Crystal structure of glycoprotein B from herpes simplex virus 1.
Science, 313, 2006
3ELU
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BU of 3elu by Molmil
Wesselsbron virus Methyltransferase in complex with AdoMet
分子名称: Methyltransferase, S-ADENOSYLMETHIONINE, SULFATE ION
著者Bollati, M, Ricagno, S, Milani, M, Mastrangelo, E, Bolognesi, M.
登録日2008-09-23
公開日2008-11-18
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Recognition of RNA Cap in the Wesselsbron Virus NS5 Methyltransferase Domain: Implications for RNA-Capping Mechanisms in Flavivirus
J.Mol.Biol., 385, 2009
1P9M
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BU of 1p9m by Molmil
Crystal structure of the hexameric human IL-6/IL-6 alpha receptor/gp130 complex
分子名称: Interleukin-6, Interleukin-6 receptor alpha chain, Interleukin-6 receptor beta chain
著者Boulanger, M.J, Chow, D.C, Brevnova, E.E, Garcia, K.C.
登録日2003-05-12
公開日2003-07-01
最終更新日2023-08-16
実験手法X-RAY DIFFRACTION (3.65 Å)
主引用文献Hexameric Structure and Assembly of the Interleukin-6/IL-6 alpha-Receptor/gp130 Complex
Science, 300, 2003
3EMD
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BU of 3emd by Molmil
Wesselsbron virus Methyltransferase in complex with Sinefungin and 7MeGpppA
分子名称: P1-7-METHYLGUANOSINE-P3-ADENOSINE-5',5'-TRIPHOSPHATE, SINEFUNGIN, SULFATE ION, ...
著者Bollati, M, Milani, M, Ricagno, S, Mastrangelo, E, Bolognesi, M.
登録日2008-09-24
公開日2008-11-18
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Recognition of RNA Cap in the Wesselsbron Virus NS5 Methyltransferase Domain: Implications for RNA-Capping Mechanisms in Flavivirus
J.Mol.Biol., 385, 2009
6CGO
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BU of 6cgo by Molmil
Molecular basis for condensation domain-mediated chain release from the enacyloxin polyketide synthase
分子名称: Condensation domain protein, PHOSPHATE ION
著者Valentic, T.R, Tsai, S.C, Challis, G.L, Lewandowski, J.R, Kosol, S, Gallo, A, Griffiths, D, Masschelein, J.L, Jenner, M, De los Santos, E.
登録日2018-02-20
公開日2019-02-27
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structural basis for chain release from the enacyloxin polyketide synthase.
Nat.Chem., 11, 2019
4BZO
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BU of 4bzo by Molmil
Crystal structure of PIM1 in complex with a Pyrrolo-Pyrazinone inhibitor
分子名称: N-[(1S)-2-AMINO-1-PHENYLETHYL]-2-[(4S)-7-(2-FLUORO-4-PYRIDINYL)-1-OXO-1,2,3,4-TETRAHYDROPYRROLO[1,2-A]PYRAZIN-4-YL]ACETAMIDE, SERINE/THREONINE-PROTEIN KINASE PIM-1
著者Casale, E, Casuscelli, F, Ardini, E, Avanzi, N, Cervi, G, D'Anello, M, Donati, D, Faiardi, D, Ferguson, R.D, Fogliatto, G, Galvani, A, Marsiglio, A, Mirizzi, D.G, Montemartini, M, Orrenius, C, Papeo, G, Piutti, C, Salom, B, Felder, E.R.
登録日2013-07-29
公開日2013-10-30
最終更新日2013-11-13
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Discovery and Optimization of Pyrrolo[1,2-A]Pyrazinones Leads to Novel and Selective Inhibitors of Pim Kinases.
Bioorg.Med.Chem., 21, 2013

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