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6Z3V
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A4V MUTANT OF HUMAN SOD1 BOUND WITH N-ARYL BENZOISOSELENAZOLONE DERIVATIVE 13 IN P21 SPACE GROUP
Descriptor:Superoxide dismutase [Cu-Zn], ZINC ION, 5-fluoranyl-~{N}-(3-morpholin-4-ylcarbonylphenyl)-2-selanyl-benzamide, ...
Authors:Amporndanai, K., Hasnain, S.S.
Deposit date:2020-05-22
Release date:2020-09-16
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis.
Ebiomedicine, 59, 2020
6Z4G
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A4V MUTANT OF HUMAN SOD1 BOUND WITH EBSELEN IN P21 SPACE GROUP
Descriptor:Superoxide dismutase [Cu-Zn], ZINC ION, ACETATE ION, ...
Authors:Amporndanai, K., Hasnain, S.S.
Deposit date:2020-05-25
Release date:2020-09-16
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis.
Ebiomedicine, 59, 2020
6Z4H
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A4V MUTANT OF HUMAN SOD1 BOUND WITH BENZYL BENZOISOSELENAZOLONE DERIVATIVE 2 IN P21 SPACE GROUP
Descriptor:Superoxide dismutase [Cu-Zn], ZINC ION, ~{N}-[(4-chlorophenyl)methyl]-2-selanyl-benzamide, ...
Authors:Amporndanai, K., Hasnain, S.S.
Deposit date:2020-05-25
Release date:2020-09-16
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis.
Ebiomedicine, 59, 2020
6Z4I
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A4V MUTANT OF HUMAN SOD1 BOUND WITH BENZYL BENZOISOSELENAZOLONE DERIVATIVE 3 IN P21 SPACE GROUP
Descriptor:Superoxide dismutase [Cu-Zn], ZINC ION, ACETATE ION, ...
Authors:Amporndanai, K., Hasnain, S.S.
Deposit date:2020-05-25
Release date:2020-09-16
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis.
Ebiomedicine, 59, 2020
6Z4J
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A4V MUTANT OF HUMAN SOD1 BOUND WITH BENZYL BENZOISOSELENAZOLONE DERIVATIVE 5 IN P21 SPACE GROUP
Descriptor:Superoxide dismutase [Cu-Zn], ZINC ION, ~{N}-[(3-chlorophenyl)methyl]-2-selanyl-benzamide, ...
Authors:Amporndanai, K., Hasnain, S.S.
Deposit date:2020-05-25
Release date:2020-09-16
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis.
Ebiomedicine, 59, 2020
6Z4K
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A4V MUTANT OF HUMAN SOD1 BOUND WITH BENZYL BENZOISOSELENAZOLONE DERIVATIVE 6 IN P21 SPACE GROUP
Descriptor:Superoxide dismutase [Cu-Zn], ~{N}-[(3-methoxyphenyl)methyl]-2-selanyl-benzamide, ZINC ION, ...
Authors:Amporndanai, K., Hasnain, S.S.
Deposit date:2020-05-25
Release date:2020-09-16
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis.
Ebiomedicine, 59, 2020
6Z4L
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A4V MUTANT OF HUMAN SOD1 BOUND WITH 2-(PYRIDIN-3-YLMETHYL)BENZOISOSELENAZOLONE DERIVATIVE 9 IN P21 SPACE GROUP
Descriptor:Superoxide dismutase [Cu-Zn], ~{N}-(pyridin-3-ylmethyl)-2-selanyl-benzamide, ZINC ION, ...
Authors:Amporndanai, K., Hasnain, S.S.
Deposit date:2020-05-25
Release date:2020-09-16
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis.
Ebiomedicine, 59, 2020
6Z4M
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A4V MUTANT OF HUMAN SOD1 BOUND WITH 2-(PYRIDIN-3-YLMETHYL)BENZOISOSELENAZOLONE DERIVATIVE 10 IN P21 SPACE GROUP
Descriptor:Superoxide dismutase [Cu-Zn], ~{N}-[(6-methoxypyridin-3-yl)methyl]-2-selanyl-benzamide, ZINC ION, ...
Authors:Amporndanai, K., Hasnain, S.S.
Deposit date:2020-05-25
Release date:2020-09-16
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis.
Ebiomedicine, 59, 2020
6Z4O
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A4V MUTANT OF HUMAN SOD1 BOUND WITH BENZYL BENZOISOSELENAZOLONE DERIVATIVE 1 IN P21 SPACE GROUP
Descriptor:Superoxide dismutase [Cu-Zn], ZINC ION, ~{N}-(phenylmethyl)-2-selanyl-benzamide, ...
Authors:Amporndanai, K., Hasnain, S.S.
Deposit date:2020-05-25
Release date:2020-09-16
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis.
Ebiomedicine, 59, 2020
5OKD
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CRYSTAL STRUCTURE OF BOVINE CYTOCHROME BC1 IN COMPLEX WITH INHIBITOR SCR0911.
Descriptor:Cytochrome b-c1 complex subunit 1, mitochondrial, Cytochrome b-c1 complex subunit 2, ...
Authors:Amporndanai, K., O'Neill, P.M., Hasnain, S.S., Antonyuk, S.V.
Deposit date:2017-07-25
Release date:2018-02-28
Last modified:2018-05-30
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:X-ray and cryo-EM structures of inhibitor-bound cytochromebc1complexes for structure-based drug discovery.
IUCrJ, 5, 2018
6XVF
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CRYSTAL STRUCTURE OF BOVINE CYTOCHROME BC1 IN COMPLEX WITH TETRAHYDRO-QUINOLONE INHIBITOR JAG021
Descriptor:Cytochrome b-c1 complex subunit 1, mitochondrial, Cytochrome b-c1 complex subunit 2, ...
Authors:Amporndanai, K., Hasnain, S.S., Antonyuk, S.V.
Deposit date:2020-01-21
Release date:2020-07-22
Method:X-RAY DIFFRACTION (3.5 Å)
Cite:Potent Tetrahydroquinolone Eliminates Apicomplexan Parasites.
Front Cell Infect Microbiol, 10, 2020
6FO0
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CRYOEM STRUCTURE OF BOVINE CYTOCHROME BC1 IN COMPLEX WITH THE ANTI-MALARIAL COMPOUND GSK932121
Descriptor:Cytochrome b-c1 complex subunit 1, mitochondrial, Cytochrome b-c1 complex subunit 2, ...
Authors:Johnson, R.M., Amporndanai, K., O'Neill, P.M., Fishwick, C.W.G., Jamson, A.H., Rawson, S.D., Hasnain, S.S., Antonyuk, S.V., Muench, S.P.
Deposit date:2018-02-05
Release date:2018-02-28
Last modified:2019-12-11
Method:ELECTRON MICROSCOPY (4.1 Å)
Cite:X-ray and cryo-EM structures of inhibitor-bound cytochromebc1complexes for structure-based drug discovery.
IUCrJ, 5, 2018
6FO2
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CRYOEM STRUCTURE OF BOVINE CYTOCHROME BC1 WITH NO LIGAND BOUND
Descriptor:Cytochrome b-c1 complex subunit 1, mitochondrial, Cytochrome b-c1 complex subunit 2, ...
Authors:Johnson, R.M., Amporndanai, K., O'Neill, P.M., Fishwick, C.W.G., Jamson, A.H., Rawson, S.D., Hasnain, S.S., Antonyuk, S.V., Muench, S.P.
Deposit date:2018-02-05
Release date:2018-02-28
Last modified:2019-12-11
Method:ELECTRON MICROSCOPY (4.4 Å)
Cite:X-ray and cryo-EM structures of inhibitor-bound cytochromebc1complexes for structure-based drug discovery.
IUCrJ, 5, 2018
6FO6
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CRYOEM STRUCTURE OF BOVINE CYTOCHROME BC1 IN COMPLEX WITH THE ANTI-MALARIAL INHIBITOR SCR0911
Descriptor:Cytochrome b-c1 complex subunit Rieske, mitochondrial, Cytochrome b-c1 complex subunit 1, ...
Authors:Johnson, R.M., Amporndanai, K., O'Neill, P.M., Fishwick, C.W.G., Jamson, A.H., Rawson, S.D., Hasnain, S.S., Antonyuk, S.V., Muench, S.P.
Deposit date:2018-02-06
Release date:2018-02-28
Last modified:2019-12-11
Method:ELECTRON MICROSCOPY (4.1 Å)
Cite:X-ray and cryo-EM structures of inhibitor-bound cytochromebc1complexes for structure-based drug discovery.
IUCrJ, 5, 2018
6HAW
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CRYSTAL STRUCTURE OF BOVINE CYTOCHROME BC1 IN COMPLEX WITH 2-PYRAZOLYL QUINOLONE INHIBITOR WDH2G7
Descriptor:Cytochrome b-c1 complex subunit 1, mitochondrial, Cytochrome b-c1 complex subunit 2, ...
Authors:Amporndanai, K., Hong, W.D., O'Neill, P.M., Hasnain, S.S., Antonyuk, S.V.
Deposit date:2018-08-08
Release date:2019-01-16
Method:X-RAY DIFFRACTION (3.45 Å)
Cite:Potent Antimalarial 2-Pyrazolyl Quinolonebc1(Qi) Inhibitors with Improved Drug-like Properties.
ACS Med Chem Lett, 9, 2018
6SPA
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A4V MUTANT OF HUMAN SUPEROXIDE DISMUTASE 1 IN C2 SPACE GROUP
Descriptor:Superoxide dismutase [Cu-Zn], ZINC ION, GLYCEROL, ...
Authors:Shahid, M., Chantadul, V., Amporndanai, K., Wright, G., Antonyuk, S., Hasnain, S.
Deposit date:2019-08-31
Release date:2020-03-18
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Ebselen as template for stabilization of A4V mutant dimer for motor neuron disease therapy.
Commun Biol, 3, 2020
6SPH
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A4V MUTANT OF HUMAN SUPEROXIDE DISMUTASE 1 WITH EBSELEN BOND IN C2 SPACE GROUP
Descriptor:Superoxide dismutase [Cu-Zn], ZINC ION, ~{N}-phenyl-2-selanyl-benzamide, ...
Authors:Shahid, M., Chantadul, V., Amporndanai, K., Wright, G., Antonyuk, S., Hasnain, S.
Deposit date:2019-09-01
Release date:2020-03-18
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Ebselen as template for stabilization of A4V mutant dimer for motor neuron disease therapy.
Commun Biol, 3, 2020
6SPI
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A4V MUTANT OF HUMAN SOD1 WITH EBSELEN DERIVATIVE 4
Descriptor:Superoxide dismutase [Cu-Zn], ~{N}-[(4-chlorophenyl)methyl]-2-selanyl-benzamide, ZINC ION, ...
Authors:Chantadul, V., Amporndanai, K., Wright, G., Antonyuk, S., Hasnain, S.
Deposit date:2019-09-01
Release date:2020-03-18
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Ebselen as template for stabilization of A4V mutant dimer for motor neuron disease therapy.
Commun Biol, 3, 2020
6SPJ
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A4V MUTANT OF HUMAN SOD1 WITH EBSELEN DERIVATIVE 1
Descriptor:Superoxide dismutase [Cu-Zn], ZINC ION, ~{N}-pyridin-2-yl-2-selanyl-benzamide, ...
Authors:Chantadul, V., Amporndanai, K., Wright, G., Antonyuk, S., Hasnain, S.
Deposit date:2019-09-01
Release date:2020-03-18
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Ebselen as template for stabilization of A4V mutant dimer for motor neuron disease therapy.
Commun Biol, 3, 2020
6SPK
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A4V MUTANT OF HUMAN SOD1 WITH EBSELEN DERIVATIVE 6
Descriptor:Superoxide dismutase [Cu-Zn], ZINC ION, 2-selanyl-~{N}-[3-[4-(trifluoromethyl)phenyl]phenyl]benzamide, ...
Authors:Chantadul, V., Amporndanai, K., Wright, G., Shahid, M., Antonyuk, S., Hasnain, S.
Deposit date:2019-09-01
Release date:2020-03-18
Method:X-RAY DIFFRACTION (2.77 Å)
Cite:Ebselen as template for stabilization of A4V mutant dimer for motor neuron disease therapy.
Commun Biol, 3, 2020
6T4B
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CRYSTAL STRUCTURE OF HUMAN TDP-43 N-TERMINAL DOMAIN AT 2.55 A RESOLUTION
Descriptor:TAR DNA-binding protein 43, SULFATE ION
Authors:Watanabe, T.F., Wright, G.S.A., Amporndanai, K., Antonyuk, S.V., Hasnain, S.S.
Deposit date:2019-10-13
Release date:2020-05-20
Last modified:2020-06-10
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:Purification and Structural Characterization of Aggregation-Prone Human TDP-43 Involved in Neurodegenerative Diseases.
Iscience, 23, 2020
169117
PDB entries from 2020-09-23