Structure of PDB 3zuh Chain D Binding Site BS02

Receptor Information
>3zuh Chain D (length=286) Species: 1063 (Cereibacter sphaeroides) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PTSIDLRAEYEGSGAKEVLEELDRELIGLKPVKDRIRETAALLLVERARQ
KLGLTPTLHMSFTGNPGTGKTTVALKMAGLLHRLGYVRKGHLVSVTRDDL
VGQYIGHTAPKTKEVLKRAMGGVLFIDEAYYLYRPDNERDYGQEAIEILL
QVMENNRDDLVVILAGYADRMENFFQSNPGFRSRIAHHIEFPDYSDEELF
EIAGHMLDDQNYQMTPEAETALRAYIGLRRNQPHFANARSIRNALDRARL
RQANRLFTASSGPLDARALSTIAEEDIRASRVFKGG
Ligand information
Ligand IDADP
InChIInChI=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
InChIKeyXTWYTFMLZFPYCI-KQYNXXCUSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0c1nc(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 3.341Nc1ncnc2n(cnc12)[CH]3O[CH](CO[P](O)(=O)O[P](O)(O)=O)[CH](O)[CH]3O
ACDLabs 10.04O=P(O)(O)OP(=O)(O)OCC3OC(n2cnc1c(ncnc12)N)C(O)C3O
CACTVS 3.341Nc1ncnc2n(cnc12)[C@@H]3O[C@H](CO[P@@](O)(=O)O[P](O)(O)=O)[C@@H](O)[C@H]3O
OpenEye OEToolkits 1.5.0c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)O)O)O)N
FormulaC10 H15 N5 O10 P2
NameADENOSINE-5'-DIPHOSPHATE
ChEMBLCHEMBL14830
DrugBankDB16833
ZINCZINC000012360703
PDB chain3zuh Chain D Residue 1299 [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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PDB3zuh Structure and Function of the Aaa+ Protein Cbbx, a Red-Type Rubisco Activase.
Resolution21.0 Å
Binding residue
(original residue number in PDB)		L33 I34 L36 N75 G77 T78 G79 K80 T81 D219
Binding residue
(residue number reindexed from 1)		L26 I27 L29 N65 G67 T68 G69 K70 T71 D209
Annotation score5
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005524 ATP binding
GO:0016887 ATP hydrolysis activity

View graph for
Molecular Function
External links
PDB RCSB:3zuh, PDBe:3zuh, PDBj:3zuh
PDBsum3zuh
PubMed22048315
UniProtP95648|CBBX_CERSP Protein CbbX (Gene Name=cbbX)

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