8X8X: Crystal structure of ROCK2 with GNS-2591 inhibitor

PDB ID: 8X8XDownload
MMDB ID: 255977
PDB Deposition Date: 2023/11/29
Updated in MMDB: 2024/12
Experimental Method:
x-ray diffraction
Resolution: 2.6  Å
Source Organism:
Similar Structures:
Biological Unit for 8X8X: monomeric; determined by author
Molecular Components in 8X8X
Label Count Molecule
Protein (1 molecule)
1
Rho-associated Protein Kinase 2
(Gene symbol: ROCK2)
Molecule annotation
Chemicals and Non-standard biopolymers (3 molecules)
1
1
~{N}-methyl-3-[[1-oxidanylidene-6-[5-(trifluoromethyl)-1~{H}-pyrazol-4-yl]isoquinolin-2-yl]methyl]benzamide~{N}-methyl-3-[[1-oxidanylidene-6-[5-(trifluoromethyl)-1~{H}-pyrazol-4-yl]isoquinolin-2-yl]methyl]benzamide
2
2
SULFATE IONSULFATE ION
* Click molecule labels to explore molecular sequence information.
Citing MMDB
Madej T, Lanczycki CJ, Zhang D, Thiessen PA, Geer RC, Marchler-Bauer A, Bryant SH. " MMDB and VAST+: tracking structural similarities between macromolecular complexes. Nucleic Acids Res. 2014 Jan; 42(Database issue):D297-303