Structure of PDB 7oyw Chain B Binding Site BS02
Receptor Information
>7oyw Chain B (length=348) Species:
562
(Escherichia coli) [
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QKTLHIYNWTDYIAPDTVANFEKETGIKVVYDVFDSNEVLEGKLMAGSTG
FDLVVPSAYLLERQLTAGVFQPLDKSKLPEWKNLDPELLKLVAKHDPDNK
FAMPYMWATTGIGYNVDKVKAVLGENAPVDSWDLILKPENLEKLKSCGVS
FLDDPEEVFATVLNYLGKDPNSTKADDYTGPATDLLLKLRPNIRYFHSSQ
YINDLANGDICVAIGWAGDVWQASNRAKEAKNGVNVSFSIPKEGAMAWFD
VFAMPADAKNKDEAYQFLNYLLRPDVVAHISDHVFYANANKAATPLVSAE
VRENPGIYPPADVRAKLFTQKVQDPKIDRVRTRAWTKVKSGKLEHHHH
Ligand information
Ligand ID
3IE
InChI
InChI=1S/C4H11NO/c1-4(5)3-6-2/h4H,3,5H2,1-2H3/t4-/m0/s1
InChIKey
NXMXETCTWNXSFG-BYPYZUCNSA-N
SMILES
Software
SMILES
CACTVS 3.385
COC[C@H](C)N
OpenEye OEToolkits 2.0.7
CC(COC)N
CACTVS 3.385
COC[CH](C)N
OpenEye OEToolkits 2.0.7
C[C@@H](COC)N
Formula
C4 H11 N O
Name
(2~{S})-1-methoxypropan-2-amine
ChEMBL
DrugBank
ZINC
ZINC000002572631
PDB chain
7oyw Chain B Residue 402 [
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Receptor-Ligand Complex Structure
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PDB
7oyw
Fine-tuning spermidine binding modes in the putrescine binding protein PotF.
Resolution
1.28 Å
Binding residue
(original residue number in PDB)
W135 R342
Binding residue
(residue number reindexed from 1)
W107 R314
Annotation score
1
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0019808
polyamine binding
GO:0019810
putrescine binding
Biological Process
GO:0015846
polyamine transport
GO:0015847
putrescine transport
Cellular Component
GO:0016020
membrane
GO:0030288
outer membrane-bounded periplasmic space
GO:0042597
periplasmic space
GO:0055052
ATP-binding cassette (ABC) transporter complex, substrate-binding subunit-containing
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Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:7oyw
,
PDBe:7oyw
,
PDBj:7oyw
PDBsum
7oyw
PubMed
34801550
UniProt
P31133
|POTF_ECOLI Putrescine-binding periplasmic protein PotF (Gene Name=potF)
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