5NRA
Crystal structure of human chitotriosidase-1 (hCHIT) catalytic domain in complex with compound 7g
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A | Chitotriosidase-1 | polymer | 377 | 42224.3 | 1 | UniProt (Q13231) Pfam (PF00704) In PDB | Homo sapiens (Human) | Chitinase-1 |
2 | A | 1-(5-azanyl-4~{H}-1,2,4-triazol-3-yl)-~{N}-[2-(4-bromophenyl)ethyl]-~{N}-(2-methylpropyl)piperidin-4-amine | non-polymer | 421.4 | 1 | Chemie (95K) | |||
3 | A | GLYCEROL | non-polymer | 92.1 | 1 | Chemie (GOL) | |||
4 | water | water | 18.0 | 379 | Chemie (HOH) |
Sequence modifications
A: 22 - 387 (UniProt: Q13231)
PDB | External Database | Details |
---|---|---|
Val 388 | - | expression tag |
Pro 389 | - | expression tag |
Arg 390 | - | expression tag |
Gly 391 | - | expression tag |
Ser 392 | - | expression tag |
His 393 | - | expression tag |
His 394 | - | expression tag |
His 395 | - | expression tag |
His 396 | - | expression tag |
His 397 | - | expression tag |
His 398 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 1 |
Total formula weight | 42224.3 | |
Non-Polymers* | Number of molecules | 2 |
Total formula weight | 513.5 | |
All* | Total formula weight | 42737.8 |