Structure of PDB 8qyq Chain A Binding Site BS02

Receptor Information
>8qyq Chain A (length=781) Species: 9913 (Bos taurus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DAEMAAFGEAAPYLRKSEKERLEAQTRPFDLKKDVFVPDDKEEFVKATIL
SREGGKVTAETEHGKTVTVKEDQVLQQNPPKFDKIEDMAMLTFLHEPAVL
YNLKERYASWMIYTYSGLFCVTINPYKWLPVYNAEVVAAYRGKKRSEAPP
HIFSISDNAYQYMLTDRENQSILITGESGAGKTVNTKRVIQYFAVIAAIG
GKGTLEDQIIQANPALEAFGNAKTVRNDNSSRFGKFIRIHFGATGKLASA
DIETYLLEKSRVIFQLKAERDYHIFYQILSNKKPELLDMLLITNNPYDYA
FISQGETTVASIDDAEELMATDNAFDVLGFTTEEKNSMYKLTGAIMHFGN
MKFKLKQREQAEPDGTEEADKSAYLMGLNSADLLKGLCHPRVKVGNEYVT
KGQNVQQVVYAKGALAKAVYERMFNWMVTRINATLETKQPRQYFIGVLDI
AGFEIFDFNSFEQLCINFTNEKLQQFFNHHMFVLEQEEYKKEGIEWEFID
FGMDLQACIDLIEKPMGIMSILEEECMFPKATDMTFKAKLFDNHLGKSSN
FQKPRNIKGKPEAHFSLIHYAGTVDYNIIGWLQKNKDPLNETVVDLYKKS
SLKMLSSLFANYAGFDSFQTVSALHRENLNKLMTNLRSTHPHFVRCIIPN
ETKSPGVIDNPLVMHQLRCNGVLEGIRICRKGFPNRILYGDFRQRYRILN
PAAIPEGQFIDSRKGAEKLLGSLDIDHNQYKFGHTKVFFKAGLLGLLEEM
RDERLSRIITRIQAQSRGVLSRMEFKKLLER
Ligand information
Ligand IDBEF
InChIInChI=1S/Be.3FH/h;3*1H/q+2;;;/p-3
InChIKeyOGIAHMCCNXDTIE-UHFFFAOYSA-K
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0[Be-](F)(F)F
ACDLabs 10.04
CACTVS 3.341		F[Be-](F)F
FormulaBe F3
NameBERYLLIUM TRIFLUORIDE ION
ChEMBL
DrugBank
ZINC
PDB chain8qyq Chain A Residue 1002 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB8qyq Omecamtiv mecarbil and Mavacamten target the same myosin pocket despite antagonistic effects in heart contraction.
Resolution2.61 Å
Binding residue
(original residue number in PDB)		S180 G181 K184 N238 S241 S242 G464
Binding residue
(residue number reindexed from 1)		S178 G179 K182 N227 S230 S231 G452
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0003774 cytoskeletal motor activity
GO:0005524 ATP binding
GO:0051015 actin filament binding
Cellular Component
GO:0016459 myosin complex

View graph for
Molecular Function
View graph for
Cellular Component
External links
PDB RCSB:8qyq, PDBe:8qyq, PDBj:8qyq
PDBsum8qyq
PubMed38014327
UniProtQ9BE39|MYH7_BOVIN Myosin-7 (Gene Name=MYH7)

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