7JNT

CRYSTAL STRUCTURE OF RHO-ASSOCIATED PROTEIN KINASE 2 (ROCK2) IN COMPLEX WITH A POTENT AND SELECTIVE DUAL ROCK 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, E...	Rho-associated protein kinase 2	polymer	399	45700.9	8	UniProt (O75116) Pfam (PF00069) In PDB	Homo sapiens (Human)	Rho kinase 2,Rho-associated,coiled-coil-containing protein kinase 2,coiled-coil-containing protein kinase II,ROCK-II,p164 ROCK-2
2	A, B, C, D, E...	N-[(3-methoxyphenyl)methyl]-5H-[1]benzopyrano[3,4-c]pyridine-8-carboxamide	non-polymer		346.4	8	Chemie (VFA)
3	A, D, E, F, G...	2-(N-MORPHOLINO)-ETHANESULFONIC ACID	non-polymer		195.2	6	Chemie (MES)
4	B, C, F	CHLORIDE ION	non-polymer		35.5	3	Chemie (CL)
5		water	water		18.0	273	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	8
	Total formula weight	365607.3
Non-Polymers*	Number of molecules	17
	Total formula weight	4048.8
All*	Total formula weight	369656.1

*Water molecules are not included.