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Attributes

UniProt ID
Protein Name
Rho-associated protein kinase 2
Ligand Name
(1s,4s)-4-(4-fluorophenyl)-4-hydroxy-6'-(5-methyl-1H-pyrazol-4-yl)-1'H-spiro[cyclohexane-1,2'-thieno[3,2-d]pyrimidin]-4'(3'H)-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
NCRZDERILSVITP-OYRHEFFESA-N
SMILES
Cc1c(cn[nH]1)c2cc3c(s2)C(=O)NC4(N3)CCC(CC4)(c5ccc(cc5)F)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 5U7R
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Color Legend
Unassigned regionsLigand / hetero atomse5u7rA1e5u7rB1e5u7rC1e5u7rD1
ECOD domains from experimental PDB structures interacting with ligand 81G
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
O75116n/a81G5u7re5u7rA1A:25-417
O75116n/a81G5u7re5u7rB1B:25-417
O75116n/a81G5u7re5u7rC1C:25-417
O75116n/a81G5u7re5u7rD1D:25-417