Structure of PDB 8g98 Chain A Binding Site BS01

Receptor Information
>8g98 Chain A (length=400) Species: 557600 (Acinetobacter baumannii AB307-0294) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TKNVIRGKYHPEFLQNEVLADIFAHTAQTLPDKTALIEADKTLSYGELYQ
QALIMAQHLALKGVKPGHIVGLWLPRGIELLKAQLAICLSGAAWLPFDMD
TPADRIAVCLEDAEAVGMITTDEWYEHLAEVPQTKWTNTELQKPLSESVS
LAKTTPDQPAYIIYTSKPKGIVITQKNICHFLRSENSILGIQEQDKVYQG
FSVAFDMSFEEIWLSYLVGATLWIAPKSLVSDPERLCQTLKQEQITVLHA
VPTLLALFPEDVPNLRIINLGGEMCPDSLVDRWALPHHQMFNTYGPTETT
VSASLELLERGKPVTIGKPLPNYGMLVINSERELLEQGETGELCIFGPSV
AQGYLGRPDLTADKFIENPWAMSVEEELLYRTGDLAKIDEFGQVHCLGRA
Ligand information
Ligand IDLYS
InChIInChI=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
InChIKeyKDXKERNSBIXSRK-YFKPBYRVSA-O
SMILES
SoftwareSMILES
CACTVS 3.341N[CH](CCCC[NH3+])C(O)=O
ACDLabs 10.04O=C(O)C(N)CCCC[NH3+]
OpenEye OEToolkits 1.5.0C(CC[NH3+])C[C@@H](C(=O)O)N
CACTVS 3.341N[C@@H](CCCC[NH3+])C(O)=O
OpenEye OEToolkits 1.5.0C(CC[NH3+])CC(C(=O)O)N
FormulaC6 H15 N2 O2
NameLYSINE
ChEMBL
DrugBank
ZINC
PDB chain8g98 Chain A Residue 505 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB8g98 Structural and functional insights into delta-poly-L-ornithine polymer biosynthesis from Acinetobacter baumannii
Resolution2.49 Å
Binding residue
(original residue number in PDB)		M218 E221 G283 T304
Binding residue
(residue number reindexed from 1)		M207 E210 G272 T293
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links