Structure of PDB 4am7 Chain B Binding Site BS01
Receptor Information
>4am7 Chain B (length=623) Species:
4932
(Saccharomyces cerevisiae) [
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EIDLNDPTATIVIHPGSNSIKIGFPKDDHPVVVPNCVAVPKKWLDLENSE
HVENVCLQREQSEEFNNIKSEMEKNFRERMRYYKRKVPGNAHEQVVSFNE
NSKPEIISEKNDPSPIEWIFDDSKLYYGSDALRCVDEKFVIRKPFRGGSF
NVKSPYYKSLAELISDVTKLLEHALNSETLNVKPTKFNQYKVVLVIPDIF
KKSHVETFIRVLLTELQFQAVAIIQESLATCYGAGISTSTCVVNIGAAET
RIACVDEGTVLEHSAITLDYGGDDITRLFALFLLQSDFPLQDWKIDSKHG
WLLAERLKKNFTTFQDADVAVQLYNFMNRSPNQPTEKYEFKLFDEVMLAP
LALFFPQIFKLIRTSSHKNSSLEFQLPESRDLFTNELNDWNSLSQFESKE
GNLYCDLNDDLKILNRILDAHNIIDQLQDKPENYGNTLKENFAPLEKAIV
QSIANASITADVTRMNSFYSNILIVGGSSKIPALDFILTDRINIWRPSLL
SSASFPQFYKKLTKEIKDLEGHYVNAPDKTEDENKQILQAQIKEKIVEEL
EEQHQNIEHQNGNEHIFPVSIIPPPRDMNPALIIWKGASVLAQIKLVEEL
FITNSDWDVHGSRILQYKCIFTY
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
4am7 Chain B Residue 1882 [
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Receptor-Ligand Complex Structure
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PDB
4am7
Interactions between the Nucleosome Histone Core and Arp8 in the Ino80 Chromatin Remodeling Complex.
Resolution
3.25 Å
Binding residue
(original residue number in PDB)
G274 S275 N276 G504 A505 E563 K566 K567 G735 S736
Binding residue
(residue number reindexed from 1)
G16 S17 N18 G246 A247 E305 K308 K309 G477 S478
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:4am7
,
PDBe:4am7
,
PDBj:4am7
PDBsum
4am7
PubMed
23213201
UniProt
Q12386
|ARP8_YEAST Actin-like protein ARP8 (Gene Name=ARP8)
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