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4UPD
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BU of 4upd by Molmil
Open conformation of O. piceae sterol esterase mutant I544W
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, STEROL ESTERASE, TRIETHYLENE GLYCOL, ...
Authors:Gutierrez-Fernandez, J, Vaquero, M.E, Prieto, A, Barriuso, J, Gonzalez, M.J, Hermoso, J.A.
Deposit date:2014-06-16
Release date:2014-09-24
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Crystal Structures of Ophiostoma Piceae Sterol Esterase: Structural Insights Into Activation Mechanism and Product Release.
J.Struct.Biol., 187, 2014
7Q4Q
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BU of 7q4q by Molmil
Magacizumab Fab fragment in complex with human LRG1 epitope
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, LRG1 epitope, Magacizumab heavy chain, ...
Authors:Gutierrez-Fernandez, J, Luecke, H.
Deposit date:2021-11-01
Release date:2022-06-15
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Structural basis of human LRG1 recognition by Magacizumab, a humanized monoclonal antibody with therapeutic potential.
Acta Crystallogr D Struct Biol, 78, 2022
6Q8X
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BU of 6q8x by Molmil
Respiratory complex I from Thermus thermophilus with bound Pyridaben.
Descriptor: FE2/S2 (INORGANIC) CLUSTER, FLAVIN MONONUCLEOTIDE, IRON/SULFUR CLUSTER, ...
Authors:Gutierrez-Fernandez, J, Minhas, G.S, Sazanov, L.A.
Deposit date:2018-12-16
Release date:2020-09-02
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (3.508 Å)
Cite:Key role of quinone in the mechanism of respiratory complex I.
Nat Commun, 11, 2020
8QCK
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BU of 8qck by Molmil
Crystal structure of mycothiol disulfide reductase Mtr from Mycobacterium smegmatis
Descriptor: Pyridine nucleotide-disulfide oxidoreductase dimerization region
Authors:Gutierrez-Fernandez, J, Hammerstad, M, Hersleth, H.-P.
Deposit date:2023-08-27
Release date:2024-03-13
Method:X-RAY DIFFRACTION (4.7 Å)
Cite:The crystal structure of mycothiol disulfide reductase (Mtr) provides mechanistic insight into the specific low-molecular-weight thiol reductase activity of Actinobacteria.
Acta Crystallogr D Struct Biol, 80, 2024
8QCJ
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BU of 8qcj by Molmil
Crystal structure of mycothiol disulfide reductase Mtr from Rhodococcus erythropolis
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, Mycothione reductase
Authors:Gutierrez-Fernandez, J, Hammerstad, M, Hersleth, H.-P.
Deposit date:2023-08-27
Release date:2024-03-13
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:The crystal structure of mycothiol disulfide reductase (Mtr) provides mechanistic insight into the specific low-molecular-weight thiol reductase activity of Actinobacteria.
Acta Crystallogr D Struct Biol, 80, 2024
6Q8W
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BU of 6q8w by Molmil
Respiratory complex I from Thermus thermophilus with bound Aureothin.
Descriptor: Aureothin, FE2/S2 (INORGANIC) CLUSTER, FLAVIN MONONUCLEOTIDE, ...
Authors:Gutierrez-Fernandez, J, Minhas, G.S, Sazanov, L.A.
Deposit date:2018-12-16
Release date:2020-09-02
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (3.4 Å)
Cite:Key role of quinone in the mechanism of respiratory complex I.
Nat Commun, 11, 2020
6Q8O
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BU of 6q8o by Molmil
Respiratory complex I from Thermus thermophilus with bound Piericidin A
Descriptor: FE2/S2 (INORGANIC) CLUSTER, FLAVIN MONONUCLEOTIDE, IRON/SULFUR CLUSTER, ...
Authors:Gutierrez-Fernandez, J, Minhas, G.S, Sazanov, L.A.
Deposit date:2018-12-15
Release date:2020-09-02
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (3.605 Å)
Cite:Key role of quinone in the mechanism of respiratory complex I.
Nat Commun, 11, 2020
6I0D
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BU of 6i0d by Molmil
Respiratory complex I from Thermus thermophilus with bound Decyl-Ubiquinone
Descriptor: 2-decyl-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione, FE2/S2 (INORGANIC) CLUSTER, FLAVIN MONONUCLEOTIDE, ...
Authors:Gutierrez-Fernandez, J, Minhas, G.S, Sazanov, L.A.
Deposit date:2018-10-25
Release date:2020-09-02
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (3.6 Å)
Cite:Key role of quinone in the mechanism of respiratory complex I.
Nat Commun, 11, 2020
6I1P
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BU of 6i1p by Molmil
Respiratory complex I from Thermus thermophilus with bound NADH
Descriptor: 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE, FE2/S2 (INORGANIC) CLUSTER, FLAVIN MONONUCLEOTIDE, ...
Authors:Gutierrez-Fernandez, J, Minhas, G.S, Sazanov, L.A.
Deposit date:2018-10-29
Release date:2020-09-02
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (3.207 Å)
Cite:Key role of quinone in the mechanism of respiratory complex I.
Nat Commun, 11, 2020
6Y11
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BU of 6y11 by Molmil
Respiratory complex I from Thermus thermophilus
Descriptor: DUF3197 domain-containing protein, FE2/S2 (INORGANIC) CLUSTER, FLAVIN MONONUCLEOTIDE, ...
Authors:Gutierrez-Fernandez, J, Minhas, G.S, Sazanov, L.A.
Deposit date:2020-02-10
Release date:2020-09-02
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (3.109 Å)
Cite:Key role of quinone in the mechanism of respiratory complex I.
Nat Commun, 11, 2020
4BE4
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BU of 4be4 by Molmil
Closed conformation of O. piceae sterol esterase
Descriptor: 1,4-DIETHYLENE DIOXIDE, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Gutierrez-Fernandez, J, Vaquero, M.E, Prieto, A, Barriuso, J, Gonzalez, M.J, Hermoso, J.A.
Deposit date:2013-03-05
Release date:2014-03-19
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Crystal Structures of Ophiostoma Piceae Sterol Esterase: Structural Insights Into Activation Mechanism and Product Release.
J.Struct.Biol., 187, 2014
4BE9
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BU of 4be9 by Molmil
Open conformation of O. piceae sterol esterase
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, DI(HYDROXYETHYL)ETHER, GLYCEROL, ...
Authors:Gutierrez-Fernandez, J, Vaquero, M.E, Prieto, A, Barriuso, J, Gonzalez, M.J, Hermoso, J.A.
Deposit date:2013-03-06
Release date:2014-03-26
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal Structures of Ophiostoma Piceae Sterol Esterase: Structural Insights Into Activation Mechanism and Product Release.
J.Struct.Biol., 187, 2014
4CNL
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BU of 4cnl by Molmil
Crystal structure of the Choline-binding domain of CbpL from Streptococcus pneumoniae
Descriptor: CHOLINE ION, GLYCEROL, PUTATIVE PNEUMOCOCCAL SURFACE PROTEIN, ...
Authors:Gutierrez-Fernandez, J, Bartual, S.G, Hermoso, J.A.
Deposit date:2014-01-23
Release date:2015-02-18
Last modified:2016-12-14
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Modular Architecture and Unique Teichoic Acid Recognition Features of Choline-Binding Protein L (Cbpl) Contributing to Pneumococcal Pathogenesis.
Sci.Rep., 6, 2016
3ZH3
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BU of 3zh3 by Molmil
crystal structure of S. pneumoniae D39 native MurA1
Descriptor: UDP-N-ACETYLGLUCOSAMINE 1-CARBOXYVINYLTRANSFERASE
Authors:Gutierrez-Fernandez, J, Hermoso, J.A.
Deposit date:2012-12-20
Release date:2013-04-24
Last modified:2013-05-29
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Heteroresistance to Fosfomycin is Predominant in Streptococcus Pneumoniae and Depends on Mura1 Gene.
Antimicrob.Agents Chemother., 57, 2013
3ZH4
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BU of 3zh4 by Molmil
crystal structure of S. pneumoniae Hungary 19A MurA1 in complex with citrate
Descriptor: CITRATE ANION, DI(HYDROXYETHYL)ETHER, UDP-N-ACETYLGLUCOSAMINE 1-CARBOXYVINYLTRANSFERASE
Authors:Gutierrez-Fernandez, J, Hermoso, J.A.
Deposit date:2012-12-20
Release date:2013-04-24
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Heteroresistance to Fosfomycin is Predominant in Streptococcus Pneumoniae and Depends on Mura1 Gene.
Antimicrob.Agents Chemother., 57, 2013
4D0Y
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BU of 4d0y by Molmil
Crystal structure of DacB from Streptococcus pneumoniae D39
Descriptor: DACB, PHOSPHATE ION, ZINC ION
Authors:Gutierrez-Fernandez, J, Hermoso, J.A.
Deposit date:2014-04-30
Release date:2014-08-06
Last modified:2014-09-17
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structure of the Pneumococcal L,D-Carboxypeptidase Dacb and Pathophysiological Effects of Disabled Cell Wall Hydrolases Daca and Dacb.
Mol.Microbiol., 93, 2014
5J8T
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BU of 5j8t by Molmil
NMR structure of Excalibur domain of CbpL
Descriptor: CALCIUM ION, Choline binding protein
Authors:Pantoja-Uceda, D, Trevino, M.A, Bruix, M.
Deposit date:2016-04-08
Release date:2017-05-10
Last modified:2019-10-23
Method:SOLUTION NMR
Cite:Molecular Choline-bindind Protein L Involved in Pneumococcal Adhesion and Virulence through Exposed Excalibur domanin
To Be Published
6ZJN
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BU of 6zjn by Molmil
Respiratory complex I from Thermus thermophilus, NADH dataset, minor state
Descriptor: FE2/S2 (INORGANIC) CLUSTER, IRON/SULFUR CLUSTER, NADH-quinone oxidoreductase subunit 1, ...
Authors:Kaszuba, K, Tambalo, M, Gallagher, G.T, Sazanov, L.A.
Deposit date:2020-06-29
Release date:2020-09-02
Method:ELECTRON MICROSCOPY (6.1 Å)
Cite:Key role of quinone in the mechanism of respiratory complex I.
Nat Commun, 11, 2020
6ZJL
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BU of 6zjl by Molmil
Respiratory complex I from Thermus thermophilus, NAD+ dataset, major state
Descriptor: FE2/S2 (INORGANIC) CLUSTER, FLAVIN MONONUCLEOTIDE, IRON/SULFUR CLUSTER, ...
Authors:Kaszuba, K, Tambalo, M, Gallagher, G.T, Sazanov, L.A.
Deposit date:2020-06-29
Release date:2020-09-02
Method:ELECTRON MICROSCOPY (4.3 Å)
Cite:Key role of quinone in the mechanism of respiratory complex I.
Nat Commun, 11, 2020
6ZIY
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BU of 6ziy by Molmil
Respiratory complex I from Thermus thermophilus, NADH dataset, major state
Descriptor: 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE, FE2/S2 (INORGANIC) CLUSTER, FLAVIN MONONUCLEOTIDE, ...
Authors:Kaszuba, K, Tambalo, M, Gallagher, G.T, Sazanov, L.A.
Deposit date:2020-06-26
Release date:2020-09-02
Method:ELECTRON MICROSCOPY (4.25 Å)
Cite:Key role of quinone in the mechanism of respiratory complex I.
Nat Commun, 11, 2020
6ZJY
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BU of 6zjy by Molmil
Respiratory complex I from Thermus thermophilus, NAD+ dataset, minor state
Descriptor: FE2/S2 (INORGANIC) CLUSTER, IRON/SULFUR CLUSTER, NADH-quinone oxidoreductase subunit 1, ...
Authors:Kaszuba, K, Tambalo, M, Gallagher, G.T, Sazanov, L.A.
Deposit date:2020-06-29
Release date:2020-09-02
Method:ELECTRON MICROSCOPY (5.5 Å)
Cite:Key role of quinone in the mechanism of respiratory complex I.
Nat Commun, 11, 2020

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