3AS3
Crystal Structure Analysis of Chitinase A from Vibrio harveyi with novel inhibitors - W275G mutant complex structure with 2-(imidazolin-2-yl)-5-isothiocyanatobenzofuran
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A | Chitinase A | polymer | 584 | 63712.6 | 1 | UniProt (Q9AMP1) Pfam (PF08329) Pfam (PF00704) In PDB | Vibrio harveyi | |
2 | A | 2-(5-isothiocyanato-1-benzofuran-2-yl)-4,5-dihydro-1H-imidazole | non-polymer | 243.3 | 2 | Chemie (I5I) | |||
3 | A | GLYCEROL | non-polymer | 92.1 | 1 | Chemie (GOL) | |||
4 | water | water | 18.0 | 224 | Chemie (HOH) |
Sequence modifications
A: 22 - 597 (UniProt: Q9AMP1)
PDB | External Database | Details |
---|---|---|
Gly 275 | Trp 275 | engineered mutation |
Arg 598 | - | expression tag |
Ser 599 | - | expression tag |
His 600 | - | expression tag |
His 601 | - | expression tag |
His 602 | - | expression tag |
His 603 | - | expression tag |
His 604 | - | expression tag |
His 605 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 1 |
Total formula weight | 63712.6 | |
Non-Polymers* | Number of molecules | 3 |
Total formula weight | 578.7 | |
All* | Total formula weight | 64291.3 |