Structure of PDB 7msz Chain x Binding Site BS04
Receptor Information
>7msz Chain x (length=552) Species:
83332
(Mycobacterium tuberculosis H37Rv) [
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EFIYTMKKVRKAHGDKVILDDVTLSFYPGAKIGVVGPNGAGKSSVLRIMA
GLDKPNNGDAFLATGATVGILQQEPPLNEDKTVRGNVEEGMGDIKIKLDR
FNEVAELMATDYTDELMEEMGRLQEELDHADAWDLDAQLEQAMDALRCPP
ADEPVTNLSGGERRRVALCKLLLSKPDLLLLDEPTNHLDAESVQWLEQHL
ASYPGAILAVTHDRYFLDNVAEWILELDRGRAYPYEGNYSTYLEKKAERL
AVQGRKDAKLQKRLTEELAWVRSGAKARQAKSKARLQRYEEMAAEAEKTR
KLDFEEIQIPVGPRLGNVVVEVDHLDKGYDGRALIKDLSFSLPRNGIVGV
IGPNGVGKTTLFKTIVGLETPDSGSVKVGETVKLSYVDQARAGIDPRKTV
WEVVSDGLDYIQVGQTEVPSRAYVSAFGFKGPDQQKPAGVLSGGERNRLN
LALTLKQGGNLILLDEPTNDLDVETLGSLENALLNFPGCAVVISHDRWFL
DRTCTHILAWEGDDDNEAKWFWFEGNFGAYEENKVERLGVDAAVTHRKLT
RG
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
7msz Chain x Residue 601 [
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Receptor-Ligand Complex Structure
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PDB
7msz
Interplay between an ATP-binding cassette F protein and the ribosome from Mycobacterium tuberculosis.
Resolution
3.1 Å
Binding residue
(original residue number in PDB)
H15 G41 G43 K44 S45 S46 K438 V442 E447
Binding residue
(residue number reindexed from 1)
H13 G39 G41 K42 S43 S44 K436 V440 E445
Annotation score
5
Enzymatic activity
Enzyme Commision number
3.6.1.-
Gene Ontology
Molecular Function
GO:0000049
tRNA binding
GO:0005524
ATP binding
GO:0016787
hydrolase activity
GO:0016887
ATP hydrolysis activity
GO:0019843
rRNA binding
GO:0043022
ribosome binding
Biological Process
GO:0006412
translation
GO:0006417
regulation of translation
GO:0045900
negative regulation of translational elongation
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:7msz
,
PDBe:7msz
,
PDBj:7msz
PDBsum
7msz
PubMed
35064151
UniProt
P9WQK3
|ETTA_MYCTU Energy-dependent translational throttle protein EttA (Gene Name=ettA)
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