Structure of PDB 3i5f Chain A Binding Site BS01

Receptor Information
>3i5f Chain A (length=810) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MTMDFSDPDMEFLCLTRQKLMEATSIPFDGKKNCWVPDPDFGFVGAEIQS
TKGDEVTVKTDKTQETRVVKKDDIGQRNPPKFEMNMDMANLTFLNEASIL
HNLRSRYESGFIYTYSGLFCIAINPYRRLPIYTQGLVDKYRGKRRAEMPP
HLFSIADNAYQYMLQDRENQSMLITGESGAGKTENTKKVIQYFALVAASL
AEKKGTLEDQIVQCNPVLEAYGNAKTTRNNNSSRFGKFIRIHFGTQGKIA
GADIETYLLEKSRVTYQQSAERNYHIFYQLLSPAFPENIEKILAVPDPGL
YGFINQGTLTVDGIDDEEEMGLTDTAFDVLGFTDEEKLSMYKCTGCILHL
GEMKWKQRGEQAEADGTAEAEKVAFLLGVNAGDLLKCLLKPKIKVGTEYV
TQGRNKDQVTNSIAALAKSLYDRMFNWLVRRVNQTLDTKAKRQFFIGVLD
IAGFEIFDFNSFEQLCINYTNERLQQFFNHHMFVLEQEEYKKEGIVWEFI
DFGLDLQACIELIEKPMGILSILEEECMFPKASDTSFKNKLYDNHLGKNP
MFGKPKPPKAGCAEAHFCLHHYAGSVSYSIAGWLDKNKDPINENVVELLQ
NSKEPIVKMLFTPAFQTISSVHKESLNKLMKNLYSTHPHFVRCIIPNELK
TPGLIDAALVLHQLRCNGVLEGIRICRKGFPNRIIYSEFKQRYSILAPNA
VPSGFADGKVVTDKALSALQLDPNEYRLGNTKVFFKAGVLGMLEDMRDER
LSKIISMFQAHIRGYLMRKAYKKLQDQRIGLTLIQRNVRKWLVLRNWEWW
RLFNKVKPLL
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 chain3i5f Chain A Residue 1001 [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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PDB3i5f Rigor-like structures from muscle myosins reveal key mechanical elements in the transduction pathways of this allosteric motor.
Resolution3.1 Å
Binding residue
(original residue number in PDB)		K182 S246
Binding residue
(residue number reindexed from 1)		K182 S233
Annotation score4
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

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Molecular Function
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Cellular Component
External links
PDB RCSB:3i5f, PDBe:3i5f, PDBj:3i5f
PDBsum3i5f
PubMed17502101
UniProtO44934

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