3NCZ
X-Ray Co-structure of Rho-Associated Protein Kinase (ROCK1) with a potent 2H-isoquinolin-1-one inhibitor
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 (A, B, C, D) | Rho-associated protein kinase 1 | polymer | 415 | 48012.3 | 4 | UniProt (Q13464) Pfam (PF00069) | Homo sapiens (human) | Rho-associated, coiled-coil-containing protein kinase 1, p160 ROCK-1, p160ROCK, Renal carcinoma antigen NY-REN-35 |
| 2 | E, F, G, H (A, B, C, D) | cis-4-amino-N-(7-chloro-1-oxo-1,2-dihydroisoquinolin-6-yl)cyclohexanecarboxamide | non-polymer | 319.8 | 4 | Chemie (3NC) | |||
| 3 | I, J, K, L (A, B, C, D) | water | water | 18.0 | 63 | Chemie (HOH) |
Sequence modifications
A, B, C, D: 6 - 415 (UniProt: Q13464)
| PDB | External Database | Details |
|---|---|---|
| Gly 1 | - | expression tag |
| Ser 2 | - | expression tag |
| Leu 3 | - | expression tag |
| His 4 | - | expression tag |
| Met 5 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 4 |
| Total formula weight | 192049.1 | |
| Non-Polymers* | Number of molecules | 4 |
| Total formula weight | 1279.1 | |
| All* | Total formula weight | 193328.3 |
