5QCG
Crystal structure of human Cathepsin-S with bound ligand
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A, B | Cathepsin S | polymer | 223 | 24516.5 | 2 | UniProt (P25774) Pfam (PF00112) In PDB | Homo sapiens (Human) | |
2 | A, B | SULFATE ION | non-polymer | 96.1 | 2 | Chemie (SO4) | |||
3 | A, B | N-benzyl-1-{2-chloro-5-[2-(2-chloro-5-{5-(methylsulfonyl)-1-[3-(morpholin-4-yl)propyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl}phenyl)ethyl]phenyl}methanamine | non-polymer | 696.7 | 2 | Chemie (BJJ) | |||
4 | water | water | 18.0 | 196 | Chemie (HOH) |
Sequence modifications
A, B: 0 - 217 (UniProt: P25774)
PDB | External Database | Details |
---|---|---|
Ser 25 | Cys 139 | engineered mutation |
Leu 218 | - | expression tag |
Gln 219 | - | expression tag |
Gly 220 | - | expression tag |
Gly 221 | - | expression tag |
Gly 222 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 2 |
Total formula weight | 49032.9 | |
Non-Polymers* | Number of molecules | 4 |
Total formula weight | 1585.6 | |
All* | Total formula weight | 50618.5 |