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GENERAL
TITLE
ALDH1A2 LIGANDED WITH 1-(4-CYANOPHENYL)-N-(3-FLUOROPHENYL)-3-[4- (METHYLSULFONYL)PHENYL]-1H-PYRAZOLE-4-CARBOXAMIDE (COMPOUND CM121)
DATE LAST MODIFIED
11 Dec 2019
RELEASE
10 Jan 2018
OBSOLETE
CLASSIFICATION
OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR
EXPERIMENT TYPE
X-RAY DIFFRACTION
SPACE GROUP
P 21 21 21
RESOLUTION RANGE HIGH
2.6
RESOLUTION RANGE LOW
81.54
PUBMED ID
DOI
10.1021/ACSCHEMBIO.7B00685
LIGANDS

Chains

Structure ChainTarget ProteinGeneExpression SystemOrganismSynonimsActions
O94788 ALDH1A2, RALDH2 ESCHERICHIA COLI BL21(DE3) HUMAN
RALDH2, ALDEHYDE DEHYDROGENASE FAMILY 1 MEMBER A2, ...
Mutations
O94788 ALDH1A2, RALDH2 ESCHERICHIA COLI BL21(DE3) HUMAN
RALDH2, ALDEHYDE DEHYDROGENASE FAMILY 1 MEMBER A2, ...
Mutations
O94788 ALDH1A2, RALDH2 ESCHERICHIA COLI BL21(DE3) HUMAN
RALDH2, ALDEHYDE DEHYDROGENASE FAMILY 1 MEMBER A2, ...
Mutations
O94788 ALDH1A2, RALDH2 ESCHERICHIA COLI BL21(DE3) HUMAN
RALDH2, ALDEHYDE DEHYDROGENASE FAMILY 1 MEMBER A2, ...
Mutations
NGL Viewer is used for the molecular visualization.
  • AS Rose, AR Bradley, Y Valasatava, JM Duarte, A Prlić and PW Rose. NGL viewer: web-based molecular graphics for large complexes. Bioinformatics: bty419, 2018. doi:10.1093/bioinformatics/bty419
  • AS Rose and PW Hildebrand. NGL Viewer: a web application for molecular visualization. Nucl Acids Res (1 July 2015) 43 (W1): W576-W579 first published online April 29, 2015. doi:10.1093/nar/gkv402