Structure of PDB 6uko Chain B Binding Site BS01

Receptor Information
>6uko Chain B (length=371) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LAMARKGAQLGLVAFRRHYMITLEVPARDRSYAWLLSWLTRHSTRTQHLS
VETSYLQHESGRISTKFEFIPSPGNHFIWYQGKWIRVERNRDMQMVDLQT
GTPWESVTFTALGTDRKVFFNILEEARALALQQEEGKTVMYTAVGSEWRT
FGYPRRRRPLDSVVLQQGLADRIVKDIREFIDNPKWYIDRGIPYRRGYLL
YGPPGCGKSSFITALAGELEHSICLLSLTDSSLSDDRLNHLLSVAPQQSL
VLLEDVDAALTFSGLLNALDGVASTEARIVFMTTNYIDRLDPALIRPGRV
DLKEYVGYCSHWQLTQMFQRFYPGQAPSLAENFAEHVLKATSEISPAQVQ
GYFMLYKNDPMGAVHNIESLR
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 chain6uko Chain B Residue 1800 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6uko Structures of AAA protein translocase Bcs1 suggest translocation mechanism of a folded protein.
Resolution4.4 Å
Binding residue
(original residue number in PDB)		R1186 V1191 V1192 G1233 C1234 G1235 K1236 S1237 S1238 Q1397
Binding residue
(residue number reindexed from 1)		R158 V163 V164 G205 C206 G207 K208 S209 S210 Q350
Annotation score5
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005524 ATP binding
GO:0008566 mitochondrial protein-transporting ATPase activity
GO:0016887 ATP hydrolysis activity
Biological Process
GO:0007005 mitochondrion organization
GO:0032981 mitochondrial respiratory chain complex I assembly
GO:0033617 mitochondrial cytochrome c oxidase assembly
GO:0034551 mitochondrial respiratory chain complex III assembly
GO:0071806 protein transmembrane transport
Cellular Component
GO:0005739 mitochondrion
GO:0005743 mitochondrial inner membrane

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:6uko, PDBe:6uko, PDBj:6uko
PDBsum6uko
PubMed32042153
UniProtQ9CZP5|BCS1_MOUSE Mitochondrial chaperone BCS1 (Gene Name=Bcs1l)

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