Structure of PDB 7bvz Chain A Binding Site BS01

Receptor Information
>7bvz Chain A (length=329) Species: 2133 (Spiroplasma citri) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PETRPFISLDLGTANVLAYVSGQGVVYNEPSLMAYNNKTNSLIALGKAAY
DMVGKTHGDIRMVTPLVDGVIADMEAAQDLLKHIFSRMKMMKNAIVLLAC
PSGVTELEREALKNVAKEMGAELVIIEEEAKMAALGAGINIELPQGHLII
DIGGGTTDLAIISSGDIVVSRSIKVAGNHFDDDIRKYIRSEYNIAIGQKT
AEDVKKFIGSLVKYHNERSMQIYGRDIVSGLPKEAKISSEEIRNVLLNAF
SKITDLVIELLENTPPELAGDIMRNGITVCGGGALIRNIDKYFFDIFQLP
TKIASDSLNCVIEGTKIFEKTIKKNIENG
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 chain7bvz Chain A Residue 401 [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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PDB7bvz MreB5 Is a Determinant of Rod-to-Helical Transition in the Cell-Wall-less Bacterium Spiroplasma.
Resolution2.3 Å
Binding residue
(original residue number in PDB)		G14 T15 A16 N17 G158 G159 E207 K210 K211 G287 L290
Binding residue
(residue number reindexed from 1)		G12 T13 A14 N15 G153 G154 E202 K205 K206 G282 L285
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Biological Process
GO:0000902 cell morphogenesis
GO:0008360 regulation of cell shape
Cellular Component
GO:0005737 cytoplasm

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:7bvz, PDBe:7bvz, PDBj:7bvz
PDBsum7bvz
PubMed32976813
UniProtQ8VQG1

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