Structure of PDB 6b0j Chain C Binding Site BS06
Receptor Information
>6b0j Chain C (length=451) Species:
53246
(Pseudoalteromonas) [
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QKPNIILIVADDLGYADVGFNGSKDIITPNIDDLAKSGTSFSDAYVAHPF
SGPSRAALMTGRYPHKIGSQFNLPTRGSNVGVPTDAKFISKLLNENNYFT
GALGKWHMGDTPQHHPNKRGFDEYYGFLGGGHNYFPDQYQPQYKKQKAQG
LKNIFEYITPLEHNGKEVKETQYITDALSREAVNFVDKAVNKKHPFFLYL
AYNAPHTPLQAKDEDMAMFPNIKNKDRKTYAGMVYAVDRGVGKLVEALKK
NNQYDNTLIVFMSDNGGKLSKGANNFPLKAGKGSTQEGGFRVPMLFHWPK
HVPAGKRFSHPVSALDLYPTFAALAGAKVEENQHLDGTNMWPAFIKNENP
HKDEPIYALRHRKGYSDAAIRMNQWKALKVNQQPWQLFNIENDISEKHDV
SKSNKALLTDMVREMEKWSWDNQQPSWFHETTEGVNWRLDAMPRFDKTFK
T
Ligand information
Ligand ID
ARG
InChI
InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/p+1/t4-/m0/s1
InChIKey
ODKSFYDXXFIFQN-BYPYZUCNSA-O
SMILES
Software
SMILES
OpenEye OEToolkits 1.5.0
C(CC(C(=O)O)N)CNC(=[NH2+])N
CACTVS 3.341
N[C@@H](CCCNC(N)=[NH2+])C(O)=O
OpenEye OEToolkits 1.5.0
C(C[C@@H](C(=O)O)N)CNC(=[NH2+])N
CACTVS 3.341
N[CH](CCCNC(N)=[NH2+])C(O)=O
ACDLabs 10.04
O=C(O)C(N)CCCN\C(=[NH2+])N
Formula
C6 H15 N4 O2
Name
ARGININE
ChEMBL
DrugBank
ZINC
PDB chain
6b0j Chain C Residue 509 [
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Receptor-Ligand Complex Structure
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PDB
6b0j
The Molecular Basis of Polysaccharide Sulfatase Activity and a Nomenclature for Catalytic Subsites in this Class of Enzyme.
Resolution
2.5 Å
Binding residue
(original residue number in PDB)
N376 E418
Binding residue
(residue number reindexed from 1)
N349 E391
Annotation score
4
External links
PDB
RCSB:6b0j
,
PDBe:6b0j
,
PDBj:6b0j
PDBsum
6b0j
PubMed
29681469
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