6B5G
ALDH1A2 liganded with NAD and (3-ethoxythiophen-2-yl){4-[4-nitro-3-(pyrrolidin-1-yl)phenyl]piperazin-1-yl}methanone (compound 6-118)
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, D (A, B, C, D) | Retinal dehydrogenase 2 | polymer | 493 | 54170.6 | 4 | UniProt (O94788) Pfam (PF00171) | Homo sapiens (Human) | RalDH2, Aldehyde dehydrogenase family 1 member A2, Retinaldehyde-specific dehydrogenase type 2, RALDH(II) |
| 2 | E, G, I, K (A, B, C, D) | NICOTINAMIDE-ADENINE-DINUCLEOTIDE | non-polymer | 663.4 | 4 | Chemie (NAD) | |||
| 3 | F, H, J, L (A, B, C, D) | (3-ethoxythiophen-2-yl){4-[4-nitro-3-(pyrrolidin-1-yl)phenyl]piperazin-1-yl}methanone | non-polymer | 430.5 | 4 | Chemie (CQY) | |||
| 4 | M, N, O, P (A, B, C, D) | water | water | 18.0 | 712 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 4 |
| Total formula weight | 216682.4 | |
| Non-Polymers* | Number of molecules | 8 |
| Total formula weight | 4375.8 | |
| All* | Total formula weight | 221058.2 |
