Structure of PDB 5r66 Chain B Binding Site BS03

Receptor Information
>5r66 Chain B (length=197) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SMLERTINLYPLTNYTFGTKEPLYEKDSSVAARFQRMREEFDKIGMRRTV
EGVLIVHEHRLPHVLLLQLGTTFFKLPGGELNPGEDEVEGLKRLMTEILG
RQDGVLQDWVIDDCIGNWWRPNFEPPQYPYIPAHITKPKEHKKLFLVQLQ
EKALFAVPKNYKLVAAPLFELYDNAPGYGPIISSLPQLLSRFNFIYN
Ligand information
Ligand IDNT7
InChIInChI=1S/C14H20N2O2/c1-11-4-3-5-13(12(11)2)15-14(17)10-16-6-8-18-9-7-16/h3-5H,6-10H2,1-2H3,(H,15,17)
InChIKeyPPTFUQPLPCCALB-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385Cc1cccc(NC(=O)CN2CCOCC2)c1C
ACDLabs 12.01N(C(=O)CN1CCOCC1)c2cccc(c2C)C
OpenEye OEToolkits 2.0.6Cc1cccc(c1C)NC(=O)CN2CCOCC2
FormulaC14 H20 N2 O2
NameN-(2,3-dimethylphenyl)-2-(morpholin-4-yl)acetamide
ChEMBLCHEMBL1605695
DrugBank
ZINCZINC000019235648
PDB chain5r66 Chain B Residue 305 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5r66 PanDDA analysis group deposition
Resolution2.02 Å
Binding residue
(original residue number in PDB)		F103 F104 Q157 Y208 P210
Binding residue
(residue number reindexed from 1)		F73 F74 Q127 Y178 P180
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Biological Process
GO:0031124 mRNA 3'-end processing
Cellular Component
GO:0005849 mRNA cleavage factor complex

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:5r66, PDBe:5r66, PDBj:5r66
PDBsum5r66
PubMed
UniProtO43809|CPSF5_HUMAN Cleavage and polyadenylation specificity factor subunit 5 (Gene Name=NUDT21)

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