Structure of PDB 5qsc Chain A Binding Site BS02

Receptor Information
>5qsc Chain A (length=171) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ELRVGLEESELWLRFKELTNEMIVTKNGRRMFPVLKVNVSGLDPNAMYSF
LLDFVAADNHRWKYVNGEWVPGGKPEPQAPSCVYIHPDSPNFGAHWMKAP
VSFSKVKLTNKLNGGGQIMLNSLHKYEPRIHIVRVGDPQRMITSHCFPET
QFIAVTAYQNEEITALKIKYN
Ligand information
Ligand IDO0P
InChIInChI=1S/C8H11FN2O2S/c1-11(14(10,12)13)6-7-3-2-4-8(9)5-7/h2-5H,6H2,1H3,(H2,10,12,13)
InChIKeyMTNUKOMLMCLFRR-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.6CN(Cc1cccc(c1)F)S(=O)(=O)N
CACTVS 3.385CN(Cc1cccc(F)c1)[S](N)(=O)=O
ACDLabs 12.01NS(N(C)Cc1cc(ccc1)F)(=O)=O
FormulaC8 H11 F N2 O2 S
NameN-[(3-fluorophenyl)methyl]-N-methylsulfuric diamide
ChEMBL
DrugBank
ZINCZINC000036924412
PDB chain5qsc Chain A Residue 302 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5qsc PanDDA analysis group deposition
Resolution1.62 Å
Binding residue
(original residue number in PDB)		E41 L42
Binding residue
(residue number reindexed from 1)		E1 L2
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0000978 RNA polymerase II cis-regulatory region sequence-specific DNA binding
GO:0003700 DNA-binding transcription factor activity
Biological Process
GO:0006355 regulation of DNA-templated transcription
GO:0045893 positive regulation of DNA-templated transcription
Cellular Component
GO:0005634 nucleus

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:5qsc, PDBe:5qsc, PDBj:5qsc
PDBsum5qsc
PubMed
UniProtO15178|TBXT_HUMAN T-box transcription factor T (Gene Name=TBXT)

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