4BTX
Crystal structure of human vascular adhesion protein-1 in complex with pyridazinone inhibitors
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B (A, B) | MEMBRANE PRIMARY AMINE OXIDASE | polymer | 737 | 81896.9 | 2 | UniProt (Q16853) Pfam (PF02727) Pfam (PF02728) Pfam (PF01179) | HOMO SAPIENS (HUMAN) | COPPER AMINE OXIDASE, HPAO, SEMICARBAZIDE-SENSITIVE AMINE OXIDASE, SSAO, VASCULAR ADHESION PROTEIN 1, VAP-1 |
| 2 | C (C) | beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose | branched | 586.5 | 1 | In PDB GlyTouCan (G15407YE) | |||
| 3 | D (D) | alpha-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose | branched | 586.5 | 1 | In PDB GlyTouCan (G62182OO) | |||
| 4 | E, L (A, B) | COPPER (II) ION | non-polymer | 63.5 | 2 | Chemie (CU) | |||
| 5 | F, G, M, N (A, B) | CALCIUM ION | non-polymer | 40.1 | 4 | Chemie (CA) | |||
| 6 | H, I, J, P, Q... (A, B) | 2-acetamido-2-deoxy-beta-D-glucopyranose | non-polymer | 221.2 | 7 | Chemie (NAG) | |||
| 7 | K, T (A, B) | 5-isopropylamino-2-phenyl-6-(1H-1,2,4-triazol-5-yl)-3(2H)-pyridazinone | non-polymer | 296.3 | 2 | Chemie (WF8) | |||
| 8 | O (B) | alpha-D-mannopyranose | non-polymer | 180.2 | 1 | Chemie (MAN) | |||
| 9 | U, V (A, B) | water | water | 18.0 | 292 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 163793.7 | |
| Branched | Number of molecules | 2 |
| Total formula weight | 1173.1 | |
| Non-Polymers* | Number of molecules | 16 |
| Total formula weight | 2608.7 | |
| All* | Total formula weight | 167575.5 |
