5J5F
X-Ray Crystal Structure of Acetylcholine Binding Protein (AChBP) in Complex with N4,N4-bis[(pyridin-2-yl)methyl]-6-(thiophen-3-yl)pyrimidine-2,4-diamine
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, E... (A, B, C, D, E...) | Acetylcholine-binding protein | polymer | 218 | 24859.5 | 10 | UniProt (P58154) Pfam (PF02931) | Lymnaea stagnalis (Great pond snail) | AchBP |
| 2 | AA, BA, HA, K, MA... (F, H, A, I, B...) | PHOSPHATE ION | non-polymer | 95.0 | 11 | Chemie (PO4) | |||
| 3 | CA, FA, IA, L, OA... (F, G, H, A, I...) | 2-acetamido-2-deoxy-beta-D-glucopyranose | non-polymer | 221.2 | 10 | Chemie (NAG) | |||
| 4 | EA, GA, KA, M, PA... (F, G, H, A, I...) | N~4~,N~4~-bis[(pyridin-2-yl)methyl]-6-(thiophen-3-yl)pyrimidine-2,4-diamine | non-polymer | 374.5 | 10 | Chemie (6GH) | |||
| 5 | DA, JA (F, H) | GLYCEROL | non-polymer | 92.1 | 2 | Chemie (GOL) | |||
| 6 | LA (H) | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 1 | Chemie (DMS) | |||
| 7 | AB, BB, SA, TA, UA... (I, J, A, B, C...) | water | water | 18.0 | 1266 | Chemie (HOH) |
Sequence modifications
A, B, C, D, E, F, G, H, I, J: 1 - 210 (UniProt: P58154)
| PDB | External Database | Details |
|---|---|---|
| Asp -7 | - | expression tag |
| Tyr -6 | - | expression tag |
| Lys -5 | - | expression tag |
| Asp -4 | - | expression tag |
| Asp -3 | - | expression tag |
| Asp -2 | - | expression tag |
| Asp -1 | - | expression tag |
| Lys 0 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 10 |
| Total formula weight | 248595.0 | |
| Non-Polymers* | Number of molecules | 34 |
| Total formula weight | 7263.7 | |
| All* | Total formula weight | 255858.7 |
