3ENS
Crystal structure of human FXA in complex with methyl (2Z)-3-[(3-chloro-1H-indol-7-yl)amino]-2-cyano-3-{[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]amino}acrylate
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, C (A, C) | Factor X light chain | polymer | 94 | 10213.3 | 2 | UniProt (P00742) Pfam (PF00008) Pfam (PF14670) | Homo sapiens (Human) | |
| 2 | B, D (B, D) | Activated factor Xa heavy chain | polymer | 238 | 26871.6 | 2 | UniProt (P00742) Pfam (PF00089) | Homo sapiens (Human) | |
| 3 | E, F, G, L, R... (A, B, D) | GLYCEROL | non-polymer | 92.1 | 7 | Chemie (GOL) | |||
| 4 | H, N (B, D) | methyl (2Z)-3-[(3-chloro-1H-indol-7-yl)amino]-2-cyano-3-{[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]amino}acrylate | non-polymer | 513.0 | 2 | Chemie (ENS) | |||
| 5 | I, O (B, D) | CALCIUM ION | non-polymer | 40.1 | 2 | Chemie (CA) | |||
| 6 | J, P (B, D) | SODIUM ION | non-polymer | 23.0 | 2 | Chemie (NA) | |||
| 7 | K, Q (B, D) | 2-(N-MORPHOLINO)-ETHANESULFONIC ACID | non-polymer | 195.2 | 2 | Chemie (MES) | |||
| 8 | M, U (B, D) | ACETATE ION | non-polymer | 59.0 | 2 | Chemie (ACT) | |||
| 9 | V, W, X, Y (A, B, C, D) | water | water | 18.0 | 304 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 4 |
| Total formula weight | 74169.9 | |
| Non-Polymers* | Number of molecules | 17 |
| Total formula weight | 2305.3 | |
| All* | Total formula weight | 76475.3 |
