CRYSTAL STRUCTURE OF HUMAN CARBONYL REDUCTASE 1 IN COMPLEX WITH S-HYDROXYMETHYLGLUTATHIONE
PDB id Source Resolution
3BHM 1.8 angstroms
Ligand Information
Ligand Validity Binding
Data		 Ligand
Warnings		 Eolus Viewer
(click picture
to launch)		 Chemaxon
Viewer		 Molecular
Weight
(Da)		 Formula SMILES
NAP Valid submit data   launch gocavviewer-lite   743.405
C21 H28 N7 O17 P3
 c1cc(c[n+](c1)[C@H]2[C@@H]([C@@H]([C@H](O2)CO[P@@](=O)([O-])O[P@](=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)n4cnc5c4ncnc5N)OP(=O)(O)O)O)O)O)C(=O)N
AB3 Valid submit data   launch gocavviewer-lite   283.328
C15 H17 N5 O
 CC(C)(C)n1c2c(c(n1)c3cccc(c3)O)c(ncn2)N
AHE Valid submit data   launch gocavviewer-lite   337.349
C11 H19 N3 O7 S
 C(CC(=O)N[C@@H](CSCO)C(=O)NCC(=O)O)[C@@H](C(=O)O)N
SO4 Invalid            

HUMAN CARBONYL REDUCTASE 1 IS AN S-NITROSOGLUTATHIONE REDUCTASE J.BIOL.CHEM. V. 283 35756 2008

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90% Homology Family

The Class containing this family consists of a total of 3 families.
Leader:    1WMA
CRYSTAL STRUCTURE OF HUMAN CBR1 IN COMPLEX WITH HYDROXY-PP
PDB id Binding data Representative ligand
1WMA ic50 = 788.0 nM AB3
2PFG   DDD
3BHI   NAP
3BHJ   GSH
3BHM   NAP