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1OFE
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BU of 1ofe by Molmil
Glutamate Synthase from Synechocystis sp in complex with 2-Oxoglutarate and L-DON at 2.45 Angstrom resolution
Descriptor: 2-OXOGLUTARIC ACID, 5-OXO-L-NORLEUCINE, FE3-S4 CLUSTER, ...
Authors:Van Den heuvel, R.H.H, Mattevi, A.
Deposit date:2003-04-14
Release date:2003-06-11
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:The Active Conformation of Glutamate Synthase and its Binding to Ferredoxin
J.Mol.Biol., 330, 2003
1OFD
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BU of 1ofd by Molmil
Glutamate Synthase from Synechocystis sp in complex with 2-Oxoglutarate at 2.0 Angstrom resolution
Descriptor: 2-OXOGLUTARIC ACID, FE3-S4 CLUSTER, FERREDOXIN-DEPENDENT GLUTAMATE SYNTHASE 2, ...
Authors:Van Den heuvel, R.H.H, Mattevi, A.
Deposit date:2003-04-14
Release date:2003-06-11
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:The Active Conformation of Glutamate Synthase and its Binding to Ferredoxin
J.Mol.Biol., 330, 2003
1OFF
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BU of 1off by Molmil
2Fe-2S Ferredoxin from Synechocystis sp. PCC 6803
Descriptor: FE2/S2 (INORGANIC) CLUSTER, FERREDOXIN I
Authors:Van Den heuvel, R.H.H, Mattevi, A.
Deposit date:2003-04-14
Release date:2003-06-11
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:The Active Conformation of Glutamate Synthase and its Binding to Ferredoxin
J.Mol.Biol., 330, 2003
1X9Y
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BU of 1x9y by Molmil
The prostaphopain B structure
Descriptor: cysteine proteinase
Authors:Filipek, R, Szczepanowski, R, Sabat, A, Potempa, J, Bochtler, M.
Deposit date:2004-08-24
Release date:2004-11-23
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Prostaphopain B structure: a comparison of proregion-mediated and staphostatin-mediated protease inhibition.
Biochemistry, 43, 2004
4W5C
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BU of 4w5c by Molmil
Crystal structure analysis of cruzain with three Fragments: 1 (N-(1H-benzimidazol-2-yl)-1,3-dimethyl-pyrazole-4-carboxamide), 6 (2-amino-4,6-difluorobenzothiazole) and 9 (N-(1H-benzimidazol-2-yl)-3-(4-fluorophenyl)-1H-pyrazole-4-carboxamide).
Descriptor: 4,6-difluoro-1,3-benzothiazol-2-amine, Cruzipain, N-(1H-benzimidazol-2-yl)-1,3-dimethyl-1H-pyrazole-4-carboxamide, ...
Authors:Tochowicz, A, McKerrow, J.H, Craik, C.S.
Deposit date:2014-08-17
Release date:2015-04-08
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (3.27 Å)
Cite:Applying Fragments Based- Drug Design to identify multiple binding modes on cysteine protease.
To Be Published
4W5B
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BU of 4w5b by Molmil
Crystal structure analysis of cruzain with Fragment 1 (N-(1H-benzimidazol-2-yl)-1,3-dimethyl-pyrazole-4-carboxamide)
Descriptor: Cruzipain, N-(1H-benzimidazol-2-yl)-1,3-dimethyl-1H-pyrazole-4-carboxamide
Authors:Tochowicz, A, McKerrow, J.H, Craik, C.S.
Deposit date:2014-08-17
Release date:2015-03-04
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2.701 Å)
Cite:Applying Fragments Based- Drug Design to identify multiple binding modes on cysteine protease.
To Be Published
1FWJ
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BU of 1fwj by Molmil
KLEBSIELLA AEROGENES UREASE, NATIVE
Descriptor: NICKEL (II) ION, UREASE
Authors:Pearson, M.A, Karplus, P.A.
Deposit date:1997-04-23
Release date:1997-10-15
Last modified:2024-06-05
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structures of Cys319 variants and acetohydroxamate-inhibited Klebsiella aerogenes urease.
Biochemistry, 36, 1997
5CXM
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BU of 5cxm by Molmil
Crystal structure of the cyanobacterial plasma membrane Rieske protein PetC3 from Synechocystis PCC 6803
Descriptor: Cytochrome b6/f complex iron-sulfur subunit, FE2/S2 (INORGANIC) CLUSTER, NICKEL (II) ION, ...
Authors:Veit, S, Takeda, K, Miki, K, Roegner, M.
Deposit date:2015-07-29
Release date:2016-08-03
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural and functional characterisation of the cyanobacterial PetC3 Rieske protein family.
Biochim. Biophys. Acta, 1857, 2016
8HLK
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BU of 8hlk by Molmil
Structure of McyB-C1A1 complexed with L-Leu and AMP
Descriptor: ADENOSINE MONOPHOSPHATE, LEUCINE, Microcystin synthetase B (Fragment)
Authors:Peng, Y.J.
Deposit date:2022-11-30
Release date:2023-12-13
Last modified:2024-07-03
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Modular catalytic activity of nonribosomal peptide synthetases depends on the dynamic interaction between adenylation and condensation domains.
Structure, 32, 2024
1U2T
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BU of 1u2t by Molmil
X-Ray structure of the sucrose-phosphatase (SPP) from Synechocystis sp. PCC6803 in complex with sucrose6P
Descriptor: 6-O-phosphono-beta-D-fructofuranose-(2-1)-alpha-D-glucopyranose, sucrose-phosphatase (SPP)
Authors:Fieulaine, S, Lunn, J.E, Borel, F, Ferrer, J.-L.
Deposit date:2004-07-20
Release date:2005-06-14
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:The structure of a cyanobacterial sucrose-phosphatase reveals the sugar tongs that release free sucrose in the cell
PLANT CELL, 17, 2005
1U2S
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BU of 1u2s by Molmil
X-Ray structure of the sucrose-phosphatase (SPP) from Synechocystis sp. PCC6803 in complex with glucose
Descriptor: MAGNESIUM ION, alpha-D-glucopyranose, sucrose-phosphatase
Authors:Fieulaine, S, Lunn, J.E, Borel, F, Ferrer, J.-L.
Deposit date:2004-07-20
Release date:2005-06-14
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:The structure of a cyanobacterial sucrose-phosphatase reveals the sugar tongs that release free sucrose in the cell
PLANT CELL, 17, 2005
4N6L
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BU of 4n6l by Molmil
Crystal structure of human cystatin E/M
Descriptor: Cystatin-M
Authors:Dall, E, Brandstetter, H.
Deposit date:2013-10-14
Release date:2015-02-18
Last modified:2024-11-27
Method:X-RAY DIFFRACTION (1.952 Å)
Cite:Structure and mechanism of an aspartimide-dependent Peptide ligase in human legumain.
Angew.Chem.Int.Ed.Engl., 54, 2015
4N6M
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BU of 4n6m by Molmil
Crystal structure of human cystatin E/M produced in LEXSY
Descriptor: Cystatin-M, SULFATE ION
Authors:Dall, E, Brandstetter, H.
Deposit date:2013-10-14
Release date:2015-02-18
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Structure and mechanism of an aspartimide-dependent Peptide ligase in human legumain.
Angew.Chem.Int.Ed.Engl., 54, 2015
7OI1
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BU of 7oi1 by Molmil
Crystal structure of Synechocystis sp PCC6803 guanidinium hydrolase
Descriptor: 1,2-ETHANEDIOL, CACODYLATE ION, CHLORIDE ION, ...
Authors:Fleming, J.R, Mayans, O.M.
Deposit date:2021-05-11
Release date:2021-12-15
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Discovery of a Ni 2+ -dependent guanidine hydrolase in bacteria.
Nature, 603, 2022
8KHQ
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BU of 8khq by Molmil
Bifunctional sulfoxide synthase OvoA_Th2 in complex with histidine and cysteine
Descriptor: 5-histidylcysteine sulfoxide synthase/putative 4-mercaptohistidine N1-methyltranferase, COBALT (II) ION, CYSTEINE, ...
Authors:Wang, J, Ye, K, Wang, X.Y, Yan, W.P.
Deposit date:2023-08-22
Release date:2023-12-06
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.69 Å)
Cite:Biochemical and Structural Characterization of OvoA Th2 : A Mononuclear Nonheme Iron Enzyme from Hydrogenimonas thermophila for Ovothiol Biosynthesis.
Acs Catalysis, 13, 2023
7SVR
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BU of 7svr by Molmil
The complex of dephosphorylated human cystic fibrosis transmembrane conductance regulator (CFTR) and Lumacaftor (VX-809)
Descriptor: Cystic fibrosis transmembrane conductance regulator, Lumacaftor
Authors:Fiedorczuk, K, Chen, J.
Deposit date:2021-11-19
Release date:2022-01-12
Last modified:2025-06-04
Method:ELECTRON MICROSCOPY (3.9 Å)
Cite:Mechanism of CFTR correction by type I folding correctors.
Cell, 185, 2022
4QYT
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BU of 4qyt by Molmil
Schizosaccharomyces pombe DJ-1
Descriptor: 1,2-ETHANEDIOL, MAGNESIUM ION, Uncharacterized protein C22E12.03c
Authors:Wilson, M.A.
Deposit date:2014-07-25
Release date:2014-08-06
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (1.05 Å)
Cite:Influence of peptide dipoles and hydrogen bonds on reactive cysteine pK(a) values in fission yeast DJ-1.
Febs J., 279, 2012
6O2P
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BU of 6o2p by Molmil
Complex of ivacaftor with cystic fibrosis transmembrane conductance regulator (CFTR)
Descriptor: (2S)-3-(hexadecanoyloxy)-2-[(9Z)-octadec-9-enoyloxy]propyl 2-(trimethylammonio)ethyl phosphate, ADENOSINE-5'-TRIPHOSPHATE, Cystic fibrosis transmembrane conductance regulator, ...
Authors:Liu, F, Zhang, Z, Chen, J, Levit, A, Shoichet, B.
Deposit date:2019-02-24
Release date:2019-06-26
Last modified:2024-05-15
Method:ELECTRON MICROSCOPY (3.3 Å)
Cite:Structural identification of a hotspot on CFTR for potentiation.
Science, 364, 2019
8TQD
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BU of 8tqd by Molmil
NF-Kappa-B1 Bound with a Covalent Inhibitor
Descriptor: 1-(2-bromo-4-chlorophenyl)-N-{(3S)-1-[(E)-iminomethyl]pyrrolidin-3-yl}methanesulfonamide, Nuclear factor NF-kappa-B p105 subunit
Authors:Hilbert, B.J.
Deposit date:2023-08-07
Release date:2024-04-24
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.02 Å)
Cite:DrugMap: A quantitative pan-cancer analysis of cysteine ligandability.
Cell, 187, 2024
8EJ1
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BU of 8ej1 by Molmil
Dephosphorylated human delta F508 cystic fibrosis transmembrane conductance regulator (CFTR)
Descriptor: Cystic fibrosis transmembrane conductance regulator
Authors:Fiedorczuk, K, Chen, J.
Deposit date:2022-09-16
Release date:2022-10-19
Last modified:2025-05-14
Method:ELECTRON MICROSCOPY (6.9 Å)
Cite:Molecular structures reveal synergistic rescue of Delta 508 CFTR by Trikafta modulators.
Science, 378, 2022
6O1V
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BU of 6o1v by Molmil
Complex of human cystic fibrosis transmembrane conductance regulator (CFTR) and GLPG1837
Descriptor: (2S)-3-(hexadecanoyloxy)-2-[(9Z)-octadec-9-enoyloxy]propyl 2-(trimethylammonio)ethyl phosphate, ADENOSINE-5'-TRIPHOSPHATE, CHOLESTEROL, ...
Authors:Zhang, Z, Liu, F, Chen, J, Levit, A, Shoichet, B.
Deposit date:2019-02-21
Release date:2019-06-26
Last modified:2024-03-20
Method:ELECTRON MICROSCOPY (3.2 Å)
Cite:Structural identification of a hotspot on CFTR for potentiation.
Science, 364, 2019
4GE0
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BU of 4ge0 by Molmil
Schizosaccharomyces pombe DJ-1 T114P mutant
Descriptor: 1,2-ETHANEDIOL, MAGNESIUM ION, Uncharacterized protein C22E12.03c
Authors:Madzelan, P, Labunska, T, Wilson, M.A.
Deposit date:2012-08-01
Release date:2012-08-15
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Influence of peptide dipoles and hydrogen bonds on reactive cysteine pK(a) values in fission yeast DJ-1.
Febs J., 279, 2012
1XX5
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BU of 1xx5 by Molmil
Crystal Structure of Natrin from Naja atra snake venom
Descriptor: ETHANOL, Natrin 1
Authors:Wang, J, Shen, B, Lou, X.H, Guo, M, Teng, M.K, Niu, L.W.
Deposit date:2004-11-04
Release date:2005-06-14
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Blocking effect and crystal structure of natrin toxin, a cysteine-rich secretory protein from Naja atra venom that targets the BKCa channel
Biochemistry, 44, 2005
7A0A
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BU of 7a0a by Molmil
Crystal structure of mouse CSAD in apo form
Descriptor: Cysteine sulfinic acid decarboxylase, SODIUM ION, SULFATE ION
Authors:Mahootchi, E, Raasakka, A, Haavik, J, Kursula, P.
Deposit date:2020-08-07
Release date:2021-08-18
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:The structure of cysteine sulphinic acid decarboxylase reveals structural determinants for substrate specificity of pyridoxal phosphate-dependent decarboxylases
To be published
4GE3
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BU of 4ge3 by Molmil
Schizosaccharomyces pombe DJ-1 T114V mutant
Descriptor: 1,2-ETHANEDIOL, MAGNESIUM ION, Uncharacterized protein C22E12.03c
Authors:Madzelan, P, Labunska, T, Wilson, M.A.
Deposit date:2012-08-01
Release date:2012-08-15
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Influence of peptide dipoles and hydrogen bonds on reactive cysteine pK(a) values in fission yeast DJ-1.
Febs J., 279, 2012

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數據於2025-07-09公開中

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