Structure of PDB 7yuv Chain A Binding Site BS01
Receptor Information
>7yuv Chain A (length=532) Species:
172827
(Meiothermus taiwanensis) [
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LSDLEALRKKIEEVGMPEAVKTKALKELDRLERMQQGSPEATVARTYLDW
LTEVPWSKADPEVLDINHTRQVLDEDHYGLKDVKERILEYLAVRQLTQGL
DVRNKAPILVLVGPPGVGKTSLGRSIARSMNRKFHRISLGGVRDEAEIRG
HRRTYIGAMPGKLIHAMKQVGVINPVILLDEIDKMSSDWRGDPASAMLEV
LDPEQNNTFTDHYLDVPYDLSKVFFITTANTLQTIPRPLLDRMEVIEIPG
YTNMEKQAIARQYLWPKQVRESGMEGRIEVTDAAILRVISEYTREAGVRG
LERELGKIARKGAKFWLEGAWEGLRTIDASDIPTYLGIPRYRPDKAETEP
QVGTAQGLAWTPVGGTLLTIEVAAVPGSGKLSLTGQLGEVMKESAQAALT
YLRAHTQDYGLPEDFYNKVDLHVHVPDGATPKDGPSAGITMATAIASALS
RRPARMDIAMTGEVSLRGKVMPIGGVKEKLLAAHQAGIHKIVLPKDNEAQ
LEELPKEVLEGLEIKLVEDVGEVLEYLLLPEP
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
7yuv Chain A Residue 801 [
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Receptor-Ligand Complex Structure
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PDB
7yuv
A 5+1 assemble-to-activate mechanism of the Lon proteolytic machine.
Resolution
3.8 Å
Binding residue
(original residue number in PDB)
H319 G360 T362 S363 Y493 I501 V540 R541
Binding residue
(residue number reindexed from 1)
H77 G118 T120 S121 Y251 I259 V298 R299
Annotation score
5
Enzymatic activity
Enzyme Commision number
3.4.21.53
: endopeptidase La.
Gene Ontology
Molecular Function
GO:0004176
ATP-dependent peptidase activity
GO:0004252
serine-type endopeptidase activity
GO:0005524
ATP binding
GO:0008236
serine-type peptidase activity
GO:0016887
ATP hydrolysis activity
GO:0042802
identical protein binding
GO:0043565
sequence-specific DNA binding
GO:0046872
metal ion binding
Biological Process
GO:0006508
proteolysis
GO:0006515
protein quality control for misfolded or incompletely synthesized proteins
GO:0030163
protein catabolic process
GO:0034605
cellular response to heat
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:7yuv
,
PDBe:7yuv
,
PDBj:7yuv
PDBsum
7yuv
PubMed
37957149
UniProt
A0A059VAZ3
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