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6YQI

Crystal structure of cAMP-dependent Protein Kinase (PKA) in complex with long-chain Fasudil-derivative N-[2-(propylamino)ethyl]isoquinoline-5-sulfonamide (soaked)

Summary for 6YQI
Entry DOI10.2210/pdb6yqi/pdb
DescriptorcAMP-dependent protein kinase catalytic subunit alpha, cAMP-dependent protein kinase inhibitor alpha, ~{N}-[2-(propylamino)ethyl]isoquinoline-5-sulfonamide, ... (4 entities in total)
Functional Keywordsphosphotransferase, signalling pathways, glycogen metabolism, serine/threonine kinase, transferase
Biological sourceCricetulus griseus (Chinese hamster)
More
Total number of polymer chains2
Total formula weight43480.45
Authors
Oebbeke, M.,Wienen-Schmidt, B.,Heine, A.,Klebe, G. (deposition date: 2020-04-17, release date: 2020-10-14, Last modification date: 2024-01-24)
Primary citationWienen-Schmidt, B.,Oebbeke, M.,Ngo, K.,Heine, A.,Klebe, G.
Two Methods, One Goal: Structural Differences between Cocrystallization and Crystal Soaking to Discover Ligand Binding Poses.
Chemmedchem, 16:292-300, 2021
Cited by
PubMed: 33029876
DOI: 10.1002/cmdc.202000565
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (1.42 Å)
Structure validation

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