6JIT
Complex structure of an imine reductase at 2.05 Angstrom resolution
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B, C (A, B, C) | 6-phosphogluconate dehydrogenase NAD-binding protein | polymer | 299 | 31130.5 | 3 | UniProt (D3Q3R0) Pfam (PF03446) Pfam (PF21761) | Stackebrandtia nassauensis (strain DSM 44728 / NRRL B-16338 / NBRC 102104 / LLR-40K-21) | |
| 2 | D (A) | CHLORIDE ION | non-polymer | 35.5 | 1 | Chemie (CL) | |||
| 3 | E (B) | 1-(2-phenylethyl)-3,4-dihydroisoquinoline | non-polymer | 235.3 | 1 | Chemie (LW7) | |||
| 4 | F (C) | NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE | non-polymer | 743.4 | 1 | Chemie (NAP) | |||
| 5 | G, H, I (A, B, C) | water | water | 18.0 | 600 | Chemie (HOH) |
Sequence modifications
A, B, C: 1 - 299 (UniProt: D3Q3R0)
| PDB | External Database | Details |
|---|---|---|
| Ile 123 | Thr 123 | engineered mutation |
| Leu 178 | Phe 178 | engineered mutation |
| Ala 228 | Gly 228 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 3 |
| Total formula weight | 93391.4 | |
| Non-Polymers* | Number of molecules | 3 |
| Total formula weight | 1014.2 | |
| All* | Total formula weight | 94405.6 |
