9FFD
STRUCTURE OF ALDO-KETO REDUCTASE 1C3 (AKR1C3) IN COMPLEX WITH AN INHIBITOR MEDS765
This is a non-PDB format compatible entry.
Functional Information from PROSITE/UniProt
site_id | PS00062 |
Number of Residues | 18 |
Details | ALDOKETO_REDUCTASE_2 Aldo/keto reductase family signature 2. MekckdaglAKSIGVSNF |
Chain | Residue | Details |
A | MET151-PHE168 |
site_id | PS00063 |
Number of Residues | 16 |
Details | ALDOKETO_REDUCTASE_3 Aldo/keto reductase family putative active site signature. LAKSYNeqRIrQNvQV |
Chain | Residue | Details |
A | LEU268-VAL283 |
site_id | PS00798 |
Number of Residues | 18 |
Details | ALDOKETO_REDUCTASE_1 Aldo/keto reductase family signature 1. GFRHIDSAhlynnEeqVG |
Chain | Residue | Details |
A | GLY45-GLY62 |
Functional Information from SwissProt/UniProt
site_id | SWS_FT_FI1 |
Number of Residues | 2 |
Details | ACT_SITE: Proton donor => ECO:0000250 |
Chain | Residue | Details |
A | TYR55 | |
B | TYR55 |
site_id | SWS_FT_FI2 |
Number of Residues | 14 |
Details | BINDING: BINDING => ECO:0000269|PubMed:14979715, ECO:0000269|PubMed:14996743, ECO:0000269|PubMed:15087468 |
Chain | Residue | Details |
A | THR23 | |
B | SER166 | |
B | GLN190 | |
B | TYR216 | |
B | LYS270 | |
B | ARG276 | |
A | ASP50 | |
A | SER166 | |
A | GLN190 | |
A | TYR216 | |
A | LYS270 | |
A | ARG276 | |
B | THR23 | |
B | ASP50 |
site_id | SWS_FT_FI3 |
Number of Residues | 2 |
Details | BINDING: BINDING => ECO:0000250 |
Chain | Residue | Details |
A | HIS117 | |
B | HIS117 |
site_id | SWS_FT_FI4 |
Number of Residues | 2 |
Details | SITE: Important for substrate specificity => ECO:0000250 |
Chain | Residue | Details |
A | LEU54 | |
B | LEU54 |
site_id | SWS_FT_FI5 |
Number of Residues | 2 |
Details | SITE: Lowers pKa of active site Tyr => ECO:0000250|UniProtKB:P14550 |
Chain | Residue | Details |
A | LYS84 | |
B | LYS84 |
site_id | SWS_FT_FI6 |
Number of Residues | 4 |
Details | SITE: Involved in ligand recognition and product release => ECO:0000269|PubMed:15087468 |
Chain | Residue | Details |
A | TRP227 | |
A | PHE306 | |
B | TRP227 | |
B | PHE306 |