6DXZ
Rabbit N-acylethanolamine-hydrolyzing acid amidase (NAAA) in complex with non-covalent benzothiazole-piperazine inhibitor ARN19702, in presence of Triton X-100
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A | N-acylethanolamine acid amidase alpha-subunit | polymer | 107 | 12124.1 | 1 | UniProt (G1T7U7) Pfam (PF15508) In PDB | Oryctolagus cuniculus (Rabbit) | |
| 2 | B | N-acylethanolamine acid amidase beta-subunit | polymer | 232 | 26256.7 | 1 | UniProt (G1T7U7) Pfam (PF02275) In PDB | Oryctolagus cuniculus (Rabbit) | |
| 3 | A | 2-acetamido-2-deoxy-beta-D-glucopyranose | non-polymer | 221.2 | 2 | Chemie (NAG) | |||
| 4 | A | POTASSIUM ION | non-polymer | 39.1 | 1 | Chemie (K) | |||
| 5 | A | FRAGMENT OF TRITON X-100 | non-polymer | 352.5 | 2 | Chemie (TRT) | |||
| 6 | A | 4-(2,4,4-trimethylpentan-2-yl)phenol | non-polymer | 206.3 | 1 | Chemie (27L) | |||
| 7 | B | [2-(ethylsulfonyl)phenyl][(2S)-4-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpiperazin-1-yl]methanone | non-polymer | 447.5 | 1 | Chemie (WTF) | |||
| 8 | B | 2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOL | non-polymer | 294.4 | 1 | Chemie (TON) | |||
| 9 | water | water | 18.0 | 160 | Chemie (HOH) |
Sequence modifications
A: 31 - 127 (UniProt: G1T7U7)
| PDB | External Database | Details |
|---|---|---|
| Asp 21 | - | expression tag |
| Arg 22 | - | expression tag |
| His 23 | - | expression tag |
| His 24 | - | expression tag |
| His 25 | - | expression tag |
| His 26 | - | expression tag |
| His 27 | - | expression tag |
| His 28 | - | expression tag |
| Lys 29 | - | expression tag |
| Leu 30 | - | expression tag |
| Leu 48 | - | insertion |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 38380.8 | |
| Non-Polymers* | Number of molecules | 8 |
| Total formula weight | 2134.8 | |
| All* | Total formula weight | 40515.6 |
