Structure of PDB 2j7p Chain A Binding Site BS02
Receptor Information
>2j7p Chain A (length=292) Species:
271
(Thermus aquaticus) [
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QQLSARLQEAIGRLRGRGRITEEDLKATLREIRRALMDADVNLEVARDFV
ERVREEALGKQVLESLTPAEVILATVYEALKEALGGEARLPVLKDRNLWF
LVGLQGSGKTTTAAKLALYYKGKGRRPLLVAADTQRPAAREQLRLLGEKV
GVPVLEVMDGESPESIRRRVEEKARLEARDLILVDTAGRLQIDEPLMGEL
ARLKEVLGPDEVLLVLDAMTGQEALSVARAFDEKVGVTGLVLTKLDGDAR
GGAALSARHVTGKPIYFAGVSEKPEGLEPFYPERLAGRILGM
Ligand information
Ligand ID
GNP
InChI
InChI=1S/C10H17N6O13P3/c11-10-13-7-4(8(19)14-10)12-2-16(7)9-6(18)5(17)3(28-9)1-27-32(25,26)29-31(23,24)15-30(20,21)22/h2-3,5-6,9,17-18H,1H2,(H,25,26)(H3,11,13,14,19)(H4,15,20,21,22,23,24)/t3-,5-,6-,9-/m1/s1
InChIKey
UQABYHGXWYXDTK-UUOKFMHZSA-N
SMILES
Software
SMILES
ACDLabs 10.04
O=P(O)(O)NP(=O)(O)OP(=O)(O)OCC3OC(n2cnc1c2N=C(N)NC1=O)C(O)C3O
OpenEye OEToolkits 1.5.0
c1nc2c(n1[C@H]3[C@@H]([C@@H]([C@H](O3)CO[P@](=O)(O)O[P@@](=O)(NP(=O)(O)O)O)O)O)N=C(NC2=O)N
OpenEye OEToolkits 1.5.0
c1nc2c(n1C3C(C(C(O3)COP(=O)(O)OP(=O)(NP(=O)(O)O)O)O)O)N=C(NC2=O)N
CACTVS 3.341
NC1=Nc2n(cnc2C(=O)N1)[C@@H]3O[C@H](CO[P@@](O)(=O)O[P@@](O)(=O)N[P](O)(O)=O)[C@@H](O)[C@H]3O
CACTVS 3.341
NC1=Nc2n(cnc2C(=O)N1)[CH]3O[CH](CO[P](O)(=O)O[P](O)(=O)N[P](O)(O)=O)[CH](O)[CH]3O
Formula
C10 H17 N6 O13 P3
Name
PHOSPHOAMINOPHOSPHONIC ACID-GUANYLATE ESTER
ChEMBL
CHEMBL1233085
DrugBank
DB02082
ZINC
ZINC000037868676
PDB chain
2j7p Chain D Residue 1400 [
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Receptor-Ligand Complex Structure
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PDB
2j7p
Structure of the Gmppnp-Stabilized Ng Domain Complex of the Srp Gtpases Ffh and Ftsy.
Resolution
1.97 Å
Binding residue
(original residue number in PDB)
Q107 R138
Binding residue
(residue number reindexed from 1)
Q105 R136
Annotation score
3
Enzymatic activity
Enzyme Commision number
3.6.5.4
: signal-recognition-particle GTPase.
Gene Ontology
Molecular Function
GO:0003924
GTPase activity
GO:0005525
GTP binding
GO:0016887
ATP hydrolysis activity
Biological Process
GO:0006614
SRP-dependent cotranslational protein targeting to membrane
Cellular Component
GO:0048500
signal recognition particle
View graph for
Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:2j7p
,
PDBe:2j7p
,
PDBj:2j7p
PDBsum
2j7p
PubMed
17184999
UniProt
O07347
|SRP54_THEAQ Signal recognition particle protein (Gene Name=ffh)
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