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4GIN
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BU of 4gin by Molmil
Crystal structure of the MUTB R284C mutant from crystals soaked with the inhibitor deoxynojirimycin
Descriptor: CALCIUM ION, GLYCEROL, Sucrose isomerase
Authors:Lipski, A, Ravaud, S, Robert, X, Haser, R, Aghajari, N.
Deposit date:2012-08-08
Release date:2013-02-13
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Mutations inducing an active-site aperture in Rhizobium sp. sucrose isomerase confer hydrolytic activity
Acta Crystallogr.,Sect.D, 69, 2013
4GO8
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BU of 4go8 by Molmil
Crystal Structure of the TREHALULOSE SYNTHASE MUTB, MUTANT A258V, in complex with TRIS
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CALCIUM ION, Sucrose isomerase
Authors:Lipski, A, Haser, R, Aghajari, N.
Deposit date:2012-08-19
Release date:2013-08-21
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Crystal structure of MUTB A258V mutant in complex with TRIS
To be Published, 2013
4GO9
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BU of 4go9 by Molmil
CRYSTAL STRUCTURE of the TREHALULOSE SYNTHASE MUTANT, MUTB D415N, in COMPLEX with TRIS
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CALCIUM ION, Sucrose isomerase
Authors:Lipski, A, Ravaud, S, Robert, X, Haser, R, Aghajari, N.
Deposit date:2012-08-19
Release date:2013-08-21
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:CRYSTAL STRUCTURE of the TREHALULOSE SYNTHASE MUTB, MUTANT D415N, in COMPLEX with TRIS
To be Published, 2013
4H8V
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BU of 4h8v by Molmil
Crystal structure of the trehalulose synthase MUTB in complex with trehalulose
Descriptor: 1-O-alpha-D-glucopyranosyl-D-fructose, CALCIUM ION, Sucrose isomerase
Authors:Lipski, A, Ravaud, S, Haser, R, Aghajari, N.
Deposit date:2012-09-24
Release date:2013-09-25
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Insights into product binding in sucrose isomerases from crystal structures of MutB from Rhizobium sp.
To be Published
4H8H
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BU of 4h8h by Molmil
MUTB inactive double mutant E254Q-D415N
Descriptor: CALCIUM ION, GLYCEROL, SULFATE ION, ...
Authors:Lipski, A, Haser, R, Aghajari, N.
Deposit date:2012-09-22
Release date:2013-09-25
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2 Å)
Cite:Insights into product binding in sucrose isomerases from crystal structures of MutB from Rhizobium sp.
To be Published
4GI6
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BU of 4gi6 by Molmil
Crystal structure of the MUTB F164L mutant in complex with glucose
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CALCIUM ION, GLYCEROL, ...
Authors:Lipski, A, Haser, R, Aghajari, N.
Deposit date:2012-08-08
Release date:2013-02-13
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Mutations inducing an active-site aperture in Rhizobium sp. sucrose isomerase confer hydrolytic activity
Acta Crystallogr.,Sect.D, 69, 2013
4H7V
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BU of 4h7v by Molmil
MUTB inactive double mutant D200A-D415N in complex with GLUCOSE
Descriptor: CALCIUM ION, GLYCEROL, Sucrose isomerase, ...
Authors:Lipski, A, Haser, R, Aghajari, N.
Deposit date:2012-09-20
Release date:2013-09-25
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Insights into product binding in sucrose isomerases from crystal structures of MutB from Rhizobium sp.
To be Published
4H8U
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BU of 4h8u by Molmil
MUTB inactive double mutant D200A-D415N soaked with sucrose and having as bound ligands sucrose in molecule A and the reaction product trehalulose in molecule B
Descriptor: 1-O-alpha-D-glucopyranosyl-D-fructose, CALCIUM ION, GLYCEROL, ...
Authors:Lipski, A, Haser, R, Aghajari, N.
Deposit date:2012-09-24
Release date:2013-09-25
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2 Å)
Cite:Insights into product binding in sucrose isomerases from crystal structures of MutB from Rhizobium sp.
To be Published
4H2C
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BU of 4h2c by Molmil
Trehalulose synthase MutB R284C mutant
Descriptor: CALCIUM ION, GLYCEROL, Sucrose isomerase
Authors:Lipski, A, Ravaud, S, Robert, X, Haser, R, Aghajari, N.
Deposit date:2012-09-12
Release date:2013-02-13
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Mutations inducing an active-site aperture in Rhizobium sp. sucrose isomerase confer hydrolytic activity
Acta Crystallogr.,Sect.D, 69, 2013
4HA1
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BU of 4ha1 by Molmil
MutB inactive double mutant D200A-D415N in complex with isomaltulose
Descriptor: 6-O-alpha-D-glucopyranosyl-D-fructose, CALCIUM ION, Sucrose isomerase, ...
Authors:Lipski, A, Haser, R, Aghajari, N.
Deposit date:2012-09-25
Release date:2013-09-25
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Insights into product binding in sucrose isomerases from crystal structures of MutB from Rhizobium sp.
To be Published
4U14
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BU of 4u14 by Molmil
Structure of the M3 muscarinic acetylcholine receptor bound to the antagonist tiotropium crystallized with disulfide-stabilized T4 lysozyme (dsT4L)
Descriptor: (1R,2R,4S,5S,7S)-7-{[hydroxy(dithiophen-2-yl)acetyl]oxy}-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.0~2,4~]nonane, Muscarinic acetylcholine receptor M3,Endolysin,Muscarinic acetylcholine receptor M3
Authors:Thorsen, T.S, Matt, R.A, Weis, W.I, Kobilka, B.K.
Deposit date:2014-07-15
Release date:2014-11-26
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (3.57 Å)
Cite:Modified T4 Lysozyme Fusion Proteins Facilitate G Protein-Coupled Receptor Crystallogenesis.
Structure, 22, 2014
7RY0
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BU of 7ry0 by Molmil
human Hsp90_MC domain structure
Descriptor: DIMETHYL SULFOXIDE, GLYCEROL, Heat shock protein HSP 90-alpha
Authors:Peng, S, Deng, J, Matts, R.
Deposit date:2021-08-24
Release date:2022-12-28
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structural basis of the key residue W320 responsible for Hsp90 conformational change.
J.Biomol.Struct.Dyn., 2022
7U8U
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BU of 7u8u by Molmil
hTRAP1 with inhibitors
Descriptor: Heat shock protein 75 kDa, mitochondrial, [2-hydroxy-5-(2H-isoindole-2-carbonyl)phenyl]{5-[3-(triphenyl-lambda~5~-phosphanyl)propoxy]-2H-isoindol-2-yl}methanone
Authors:Deng, J, Matts, R, Peng, S.
Deposit date:2022-03-09
Release date:2023-08-16
Method:X-RAY DIFFRACTION (3.065 Å)
Cite:Elucidation of novel TRAP1-Selective inhibitors that regulate mitochondrial processes.
Eur.J.Med.Chem., 258, 2023
7U8W
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BU of 7u8w by Molmil
hTRAP1 with inhibitors
Descriptor: Heat shock protein 75 kDa, mitochondrial, [5-(4-fluoro-2H-isoindole-2-carbonyl)-2-hydroxyphenyl](5-fluoro-2H-isoindol-2-yl)methanone
Authors:Deng, J, Matts, R, Peng, S.
Deposit date:2022-03-09
Release date:2023-08-16
Method:X-RAY DIFFRACTION (1.706 Å)
Cite:Elucidation of novel TRAP1-Selective inhibitors that regulate mitochondrial processes.
Eur.J.Med.Chem., 258, 2023
7U8X
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BU of 7u8x by Molmil
hTRAP1 with inhibitors
Descriptor: Heat shock protein 75 kDa, mitochondrial, [5-(4-fluoro-2H-isoindole-2-carbonyl)-2-hydroxyphenyl](5-methoxy-2H-isoindol-2-yl)methanone
Authors:Deng, J, Matts, R, Peng, S.
Deposit date:2022-03-09
Release date:2023-08-16
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Elucidation of novel TRAP1-Selective inhibitors that regulate mitochondrial processes.
Eur.J.Med.Chem., 258, 2023
7U8V
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BU of 7u8v by Molmil
hTRAP1 with inhibitors
Descriptor: (4-hydroxy-1,3-phenylene)bis[(2H-isoindol-2-yl)methanone], Heat shock protein 75 kDa, mitochondrial
Authors:Deng, J, Matts, R, Peng, S.
Deposit date:2022-03-09
Release date:2023-08-16
Method:X-RAY DIFFRACTION (1.448 Å)
Cite:Elucidation of novel TRAP1-Selective inhibitors that regulate mitochondrial processes.
Eur.J.Med.Chem., 258, 2023
7RY1
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BU of 7ry1 by Molmil
human Hsp90_MC domain structure
Descriptor: Heat shock protein HSP 90-alpha, N-[2-(1-MALEIMIDYL)ETHYL]-7-DIETHYLAMINOCOUMARIN-3-CARBOXAMIDE
Authors:Peng, S, Deng, J, Matts, R.
Deposit date:2021-08-24
Release date:2022-05-11
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (3.523 Å)
Cite:Crystal structure of the middle and C-terminal domains of Hsp90 alpha labeled with a coumarin derivative reveals a potential allosteric binding site as a drug target.
Acta Crystallogr D Struct Biol, 78, 2022
7RXZ
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BU of 7rxz by Molmil
human Hsp90_MC domain structure
Descriptor: Heat shock protein HSP 90-alpha
Authors:Peng, S, Deng, J, Matts, R.
Deposit date:2021-08-24
Release date:2022-12-28
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (3.152 Å)
Cite:Structural basis of the key residue W320 responsible for Hsp90 conformational change.
J.Biomol.Struct.Dyn., 2022
7LSZ
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BU of 7lsz by Molmil
Hsp90a N-terminal inhibitor
Descriptor: Heat shock protein HSP 90-alpha, {3-[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfanyl]-4-hydroxyphenyl}(1,3-dihydro-2H-isoindol-2-yl)methanone
Authors:Balch, M, Peng, S, Deng, J, Matts, R.
Deposit date:2021-02-18
Release date:2021-03-03
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Selective Inhibition of the Hsp90 alpha Isoform.
Angew.Chem.Int.Ed.Engl., 60, 2021
7LT0
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BU of 7lt0 by Molmil
Hsp90a N-terminal inhibitor
Descriptor: (1,3-dihydro-2H-isoindol-2-yl){3-[(3,4-dimethylphenyl)sulfanyl]-4-hydroxyphenyl}methanone, Heat shock protein HSP 90-alpha
Authors:Balch, M, Peng, S, Deng, J, Matts, R.
Deposit date:2021-02-18
Release date:2021-03-03
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.697 Å)
Cite:Selective Inhibition of the Hsp90 alpha Isoform.
Angew.Chem.Int.Ed.Engl., 60, 2021
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