Structure of PDB 8vev Chain C Binding Site BS01
Receptor Information
>8vev Chain C (length=211) Species:
10090
(Mus musculus) [
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EVKLEESGGGLVQPGGSMKLSCVASGFSFTNYWMNWVRQSPEKGLEWVAE
ISLKSSNYVTYYAESVKGRFTISSDKSKRSVYLQMNNLRAEDTGIYFCSL
WQTWFAYWGQGTLVTVSSAKTTPPSVYPLANSMVTLGCLVKGYFPEPVTV
TWNSGSLSSGVHTFPAVLQSDLYTLSSSVTVPSSTWPSETVTCNVAHPAS
STKVDKKIVPR
Ligand information
Ligand ID
6MD
InChI
InChI=1S/C11H15N5O4/c1-12-9-6-10(14-3-13-9)16(4-15-6)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11,17-19H,2H2,1H3,(H,12,13,14)/t5-,7-,8-,11-/m1/s1
InChIKey
VQAYFKKCNSOZKM-IOSLPCCCSA-N
SMILES
Software
SMILES
ACDLabs 12.01
n2c1c(ncnc1n(c2)C3OC(C(O)C3O)CO)NC
CACTVS 3.385
CNc1ncnc2n(cnc12)[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O
OpenEye OEToolkits 1.7.6
CNc1c2c(ncn1)n(cn2)C3C(C(C(O3)CO)O)O
OpenEye OEToolkits 1.7.6
CNc1c2c(ncn1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O
CACTVS 3.385
CNc1ncnc2n(cnc12)[CH]3O[CH](CO)[CH](O)[CH]3O
Formula
C11 H15 N5 O4
Name
N-methyladenosine
ChEMBL
CHEMBL383144
DrugBank
ZINC
ZINC000004245632
PDB chain
8vev Chain C Residue 301 [
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Receptor-Ligand Complex Structure
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PDB
8vev
Structure of a mouse IgG antibody antigen-binding fragment (Fab) targeting N6-methyladenosine (m6A), an RNA modification, m6A nucleoside ligand
Resolution
3.06 Å
Binding residue
(original residue number in PDB)
E50 W101
Binding residue
(residue number reindexed from 1)
E50 W101
Annotation score
1
External links
PDB
RCSB:8vev
,
PDBe:8vev
,
PDBj:8vev
PDBsum
8vev
PubMed
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