Structure of PDB 7cdw Chain A Binding Site BS02
Receptor Information
>7cdw Chain A (length=683) Species:
83332
(Mycobacterium tuberculosis H37Rv) [
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QKDVLTDLSRVRNFGIMAHIDAGKTTTTERILYYTGINYKIGEVHDERGI
TITSAATTTFWKDNQLNIIDTPGTVEVERNLRVLDGAVAVFDGKEGVEPQ
SEQVWRQADKYDVPRICFVNKMDKIGADFYFSVRTMGERLGANAVPIQLP
VGAEADFEGVVDLVEMNAKVWRGETKLGETYDTVEIPADLAEQAEEYRTK
LLEVVAESDEHLLEKYLGGEELTVDEIKGAIRKLTIASEIYPVLCGSAFK
NKGVQPMLDAVVDYLPSPLDVPPAIGHAPAKEDEEVVRKATTDEPFAALA
FKIATHPFFGKLTYIRVYSGTVESGSQVINATKGKKERLGKLFQMHSNKE
NPVDRASAGHIYAVIGLKDTTTGDTLSDPNQQIVLESMTFPDPVIEVAIE
PKTKSDQEKLSLSIQKLAEEDPTFKVHLDSETGQTVIGGMGELHLDILVD
RMRREFKVEANVGKPQVAYKETIKRLVQNVEYTHKKQTGGSGQFAKVIIN
LEPFTGEEGATYEFESKVTGGRIPREYIPSVDAGAQDAMQYGVLAGYPLV
NLKVTLLDGAYHEVDSSEMAFKIAGSQVLKKAAALAQPVILEPIMAVEVT
TPEDYMGDVIGDLNSRRGQIQAMEERAGARVVRAHVPLSEMFGYVGDLRS
KTQGRANYSMVFDSYSEVPANVSKEIIAKATGE
Ligand information
Ligand ID
GDP
InChI
InChI=1S/C10H15N5O11P2/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(25-9)1-24-28(22,23)26-27(19,20)21/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H2,19,20,21)(H3,11,13,14,18)/t3-,5-,6-,9-/m1/s1
InChIKey
QGWNDRXFNXRZMB-UUOKFMHZSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.7.6
c1nc2c(n1C3C(C(C(O3)COP(=O)(O)OP(=O)(O)O)O)O)N=C(NC2=O)N
CACTVS 3.385
NC1=Nc2n(cnc2C(=O)N1)[C@@H]3O[C@H](CO[P](O)(=O)O[P](O)(O)=O)[C@@H](O)[C@H]3O
CACTVS 3.385
NC1=Nc2n(cnc2C(=O)N1)[CH]3O[CH](CO[P](O)(=O)O[P](O)(O)=O)[CH](O)[CH]3O
ACDLabs 12.01
O=P(O)(O)OP(=O)(O)OCC3OC(n2cnc1c2N=C(N)NC1=O)C(O)C3O
OpenEye OEToolkits 1.7.6
c1nc2c(n1[C@H]3[C@@H]([C@@H]([C@H](O3)CO[P@](=O)(O)OP(=O)(O)O)O)O)N=C(NC2=O)N
Formula
C10 H15 N5 O11 P2
Name
GUANOSINE-5'-DIPHOSPHATE
ChEMBL
CHEMBL384759
DrugBank
DB04315
ZINC
ZINC000008215481
PDB chain
7cdw Chain B Residue 801 [
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Receptor-Ligand Complex Structure
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PDB
7cdw
Crystal Structure of Mycobacterium tuberculosis Elongation Factor G1.
Resolution
3.0 Å
Binding residue
(original residue number in PDB)
G384 K386
Binding residue
(residue number reindexed from 1)
G366 K368
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0003746
translation elongation factor activity
GO:0003924
GTPase activity
GO:0005525
GTP binding
Biological Process
GO:0006412
translation
GO:0006414
translational elongation
GO:0032790
ribosome disassembly
Cellular Component
GO:0005737
cytoplasm
GO:0005829
cytosol
GO:0005886
plasma membrane
GO:0009274
peptidoglycan-based cell wall
View graph for
Molecular Function
View graph for
Biological Process
View graph for
Cellular Component
External links
PDB
RCSB:7cdw
,
PDBe:7cdw
,
PDBj:7cdw
PDBsum
7cdw
PubMed
34540889
UniProt
P9WNM7
|EFG_MYCTU Elongation factor G (Gene Name=fusA)
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