Structure of PDB 7u6j Chain E Binding Site BS01
Receptor Information
>7u6j Chain E (length=247) Species:
1196353
(Streptomyces wuyuanensis) [
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SITAANVEELIAKNIAERFADDHEVLGLSQHFRREGYVKLPGLVSPEVFD
AVAAETHQLIDTHQKRIDIRLKETGDSPRYMSTVGQKAIATDGSLIPAVY
ESTALKGFLSRLAKEEVMGCPWDEEKYIITRQHQKGDTHGWHWGDFSFTV
IWLIEAPSLEYGGMLQCIPHTDWNKDDPRVEDYLQKHPIRSYGHAKGDLY
LLRSDTTLHRTVPLNADRTRIILNTCWASRADQQKATTHETMNAMFD
Ligand information
Ligand ID
LYS
InChI
InChI=1S/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/p+1/t5-/m0/s1
InChIKey
KDXKERNSBIXSRK-YFKPBYRVSA-O
SMILES
Software
SMILES
CACTVS 3.341
N[CH](CCCC[NH3+])C(O)=O
ACDLabs 10.04
O=C(O)C(N)CCCC[NH3+]
OpenEye OEToolkits 1.5.0
C(CC[NH3+])C[C@@H](C(=O)O)N
CACTVS 3.341
N[C@@H](CCCC[NH3+])C(O)=O
OpenEye OEToolkits 1.5.0
C(CC[NH3+])CC(C(=O)O)N
Formula
C6 H15 N2 O2
Name
LYSINE
ChEMBL
DrugBank
ZINC
PDB chain
7u6j Chain E Residue 302 [
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Receptor-Ligand Complex Structure
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PDB
7u6j
Biocatalytic control of site-selectivity and chain length-selectivity in radical amino acid halogenases.
Resolution
1.9 Å
Binding residue
(original residue number in PDB)
R83 E129 H143 H146 W147 N228 T245 M246 M249
Binding residue
(residue number reindexed from 1)
R79 E125 H139 H142 W143 N224 T241 M242 M245
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:7u6j
,
PDBe:7u6j
,
PDBj:7u6j
PDBsum
7u6j
PubMed
36913566
UniProt
A0A1H0BKU7
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