3LEP
Human Aldose Reductase mutant T113C in complex with IDD388
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A | Aldose reductase | polymer | 316 | 35900.4 | 1 | UniProt (P15121) Pfam (PF00248) In PDB | Homo sapiens (human) | AR, Aldehyde reductase |
| 2 | A | NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE | non-polymer | 743.4 | 1 | Chemie (NAP) | |||
| 3 | A | (2-{[(4-BROMO-2-FLUOROBENZYL)AMINO]CARBONYL}-5-CHLOROPHENOXY)ACETIC ACID | non-polymer | 416.6 | 1 | Chemie (388) | |||
| 4 | A | BROMIDE ION | non-polymer | 79.9 | 1 | Chemie (BR) | |||
| 5 | A | CITRIC ACID | non-polymer | 192.1 | 1 | Chemie (CIT) | |||
| 6 | water | water | 18.0 | 419 | Chemie (HOH) |
Sequence modifications
A: 0 - 315 (UniProt: P15121)
| PDB | External Database | Details |
|---|---|---|
| Ile 4 | Leu 5 | SEE REMARK 999 |
| Cys 113 | Thr 114 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 35900.4 | |
| Non-Polymers* | Number of molecules | 4 |
| Total formula weight | 1432.1 | |
| All* | Total formula weight | 37332.4 |
