Structure of PDB 7dhw Chain A Binding Site BS03
Receptor Information
>7dhw Chain A (length=726) Species:
3702
(Arabidopsis thaliana) [
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NFNPSVGSFVWVEDPDEAWIDGEVVQVNGDEIKVLCTSGKHVVTKISNAY
PKDVEAPASGVDDMTRLAYLHEPGVLQNLHSRYDINEIYTYTGSILIAVN
PFRRLPHLYSSHMMAQYKGASLGELSPHPFAVADAAYRQMINDGVSQSIL
VSGESGAGKTESTKLLMRYLAYMGGSVEQKVLESNPVLEAFGNAKTVRNN
NSSRFGKFVEIQFDEKGRISGAAIRTYLLERSRVCQVSDPERNYHCFYML
CAAPQEDVKKFKLEEPKKYHYLNQSKCLELDSINDAEEYHATRRAMDVVG
ISTEEQDAIFSVVAAILHIGNIEFAKGEEIDSSIPKDDKSLFHLKTAAEL
LSCDEKALEDSLCKRIMVTRDETITKTLDPEAATLSRDALAKVMYSRLFD
WLVDKINSSIGQDHDSKYLIGVLDIYGFESFKTNSFEQFCINLTNEKLQQ
HFNQHVFKMEQEEYKKEEINWSYIEFVDNQDILDLIEKKPGGIIALLDEA
CMFPRSTHETFAQKLYQTFKTHKRFTKPKLARSDFTICHYAGDVTYQTEL
FLDKNKDYVIAEHQALLNSSSCSFVASLFPPMSDDSKQSKFSSIGTRFKQ
QLVSLLEILNTTEPHYIRCIKPNNLLKPGIFENENILQQLRCGGVMEAIR
ISCAGYPTRKHFDEFLARFGILAPEVLVKNSDDPAACKKLLDKVGLEGYQ
IGKTKVFLRAGQMADLDTRRTEVLGR
Ligand information
Ligand ID
ADP
InChI
InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1
InChIKey
XTWYTFMLZFPYCI-KQYNXXCUSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.5.0
c1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO[P@](=O)(O)OP(=O)(O)O)O)O)N
CACTVS 3.341
Nc1ncnc2n(cnc12)[CH]3O[CH](CO[P](O)(=O)O[P](O)(O)=O)[CH](O)[CH]3O
ACDLabs 10.04
O=P(O)(O)OP(=O)(O)OCC3OC(n2cnc1c(ncnc12)N)C(O)C3O
CACTVS 3.341
Nc1ncnc2n(cnc12)[C@@H]3O[C@H](CO[P@@](O)(=O)O[P](O)(O)=O)[C@@H](O)[C@H]3O
OpenEye OEToolkits 1.5.0
c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)O)O)O)N
Formula
C10 H15 N5 O10 P2
Name
ADENOSINE-5'-DIPHOSPHATE
ChEMBL
CHEMBL14830
DrugBank
DB16833
ZINC
ZINC000012360703
PDB chain
7dhw Chain A Residue 1104 [
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Receptor-Ligand Complex Structure
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PDB
7dhw
Discovery of ultrafast myosin, its amino acid sequence, and structural features.
Resolution
2.84 Å
Binding residue
(original residue number in PDB)
N103 P104 F105 Y112 G159 G161 K162 T163 E164 N209
Binding residue
(residue number reindexed from 1)
N100 P101 F102 Y109 G156 G158 K159 T160 E161 N199
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0003774
cytoskeletal motor activity
GO:0005524
ATP binding
Cellular Component
GO:0016459
myosin complex
View graph for
Molecular Function
View graph for
Cellular Component
External links
PDB
RCSB:7dhw
,
PDBe:7dhw
,
PDBj:7dhw
PDBsum
7dhw
PubMed
35173046
UniProt
Q9LKB9
|MYO6_ARATH Myosin-6 (Gene Name=XI-2)
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