Structure of PDB 3n9l Chain A Binding Site BS02

Receptor Information
>3n9l Chain A (length=486) Species: 6239 (Caenorhabditis elegans) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PKESDRCGGCGKFTHEDKNDFQWIGCDSCQTWYHFLCSGLEQFEYYLYEK
FFCPKCVPHTGHSIRYKVVAPHRYRWYSPNEKHLGIEVGSKTWIEDFITR
ENTVPSPTDDEVCIVEDGYEFRREFEKLGGADNWGKVFMVKDMDGLNMTM
PKPGFDLEDVVKIMGSDYEVDTIDVYNQSTYSMKLDTFRKLFRDTKNRPL
LYNFLSLEFSDNNEMKEIAKPPRFVQEISMVNRLWPDVSGAEYIKLLQRE
EYLPEDQRPKVEQFCLAGMAGSYTDFHVDFGGSSVYYHILKGEKIFYIAA
PTEQNFAAYQAHETSPDTTTWFGDIANGAVKRVVIKEGQTLLIPAGWIHA
VLTPVDSLVFGGNFLHLGNLEMQMRVYHLENAIRKEIRSEEKFYFPNFEL
LHWMYMRNVLLEKITEANQEGSDMREQEKNIWTASQIMKAEMERWMDREL
RLGPEKNAILPTDDKNKIMISVRKQIEIQTKIQNAK
Ligand information
Ligand IDFE2
InChIInChI=1S/Fe/q+2
InChIKeyCWYNVVGOOAEACU-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Fe+2]
CACTVS 3.341[Fe++]
FormulaFe
NameFE (II) ION
ChEMBL
DrugBankDB14510
ZINC
PDB chain3n9l Chain A Residue 1 [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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PDB3n9l Structural insights into a dual-specificity histone demethylase ceKDM7A from Caenorhabditis elegans
Resolution2.796 Å
Binding residue
(original residue number in PDB)
H495 D497 H567
Binding residue
(residue number reindexed from 1)
H277 D279 H349
Annotation score4
Enzymatic activity
Enzyme Commision number 1.14.11.-
External links
PDB RCSB:3n9l, PDBe:3n9l, PDBj:3n9l
PDBsum3n9l
PubMed20567261
UniProtQ9GYI0|KDM7_CAEEL Lysine-specific demethylase 7 homolog (Gene Name=jmjd-1.2)

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