Structure of PDB 9f6c Chain B Binding Site BS01

Receptor Information
>9f6c Chain B (length=706) Species: 9913 (Bos taurus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LKKDVFVPDDKEEFVKATILSREGGKVTAETEHGKTVTVKEDQVLQQNPP
KFDKIEDMAMLTFLHEPAVLYNLKERYASWMIYTYSGLFCVTINPYKWLP
VYNAEVVAAYRGKKRSEAPPHIFSISDNAYQYMLTDRENQSILITGESGA
GKTVNTKRVIQYFAVIAAIGGTLEDQIIQANPALEAFGNAKTVRNDNSSR
FGKFIRIHFGATGKLASADIETYLLEKSRVIFQLKAERDYHIFYQILSNK
KPELLDMLLITNNPYDYAFISQGETTVASIDDAEELMATDNAFDVLGFTT
EEKNSMYKLTGAIMHFGNMKFKLKEQAEPDGTEEADKSAYLMGLNSADLL
KGLCHPRVKVGNEYVTKGQNVQQVVYAKGALAKAVYERMFNWMVTRINAT
LETKQPRQYFIGVLDIAGFEIFDFNSFEQLCINFTNEKLQQFFNHHMFVL
EQEEYKKEGIEWEFIDFGMDLQACIDLIEKPMGIMSILEEECMFPKATDM
TFKAKLFDNHLGKSSNFQKPRNIKPEAHFSLIHYAGTVDYNIIGWLQKNK
DPLNETVVDLYKKSSLKMLSSLFANYQTVSALHRENLNKLMTNLRSTHPH
FVRCIIPNETKSPGVIDNPLVMHQLRCNGVLEGIRICRKGFPNRILYGDF
RQRYRILNPAADSRKGAEKLLGSLDIDHNQYKFGHTKVFFKAGLLGLLEE
MRDERL
Ligand information
Ligand IDMG
InChIInChI=1S/Mg/q+2
InChIKeyJLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mg+2]
CACTVS 3.341[Mg++]
FormulaMg
NameMAGNESIUM ION
ChEMBL
DrugBankDB01378
ZINC
PDB chain9f6c Chain B Residue 801 [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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PDB9f6c Aficamten is a small-molecule cardiac myosin inhibitor designed to treat hypertrophic cardiomyopathy.
Resolution2.33 Å
Binding residue
(original residue number in PDB)		T185 S242
Binding residue
(residue number reindexed from 1)		T153 S199
Annotation score4
External links
PDB RCSB:9f6c, PDBe:9f6c, PDBj:9f6c
PDBsum9f6c
PubMed39196032
UniProtQ9BE39|MYH7_BOVIN Myosin-7 (Gene Name=MYH7)

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