Structure of PDB 7uha Chain A Binding Site BS02

Receptor Information
>7uha Chain A (length=125) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MDDIYKAAVEQLTEEQKNEFKAAFDIFVLGAEDGSISTKELGKVMRMLGQ
NPTPEELQEMIDEVDEDGSGTVDFDEFLVMMVRSMKDDSKGKFKRPTLRR
VRISADAMMQALLGARAKGHHHHHH
Ligand information
Ligand IDWW6
InChIInChI=1S/C15H19ClN2O2S/c16-14-8-4-7-13-12(14)6-5-9-15(13)21(19,20)18-11-3-1-2-10-17/h4-9,18H,1-3,10-11,17H2
InChIKeySYLYAVTWUBDUGM-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385NCCCCCN[S](=O)(=O)c1cccc2c(Cl)cccc12
OpenEye OEToolkits 2.0.7c1cc2c(cccc2Cl)c(c1)S(=O)(=O)NCCCCCN
ACDLabs 12.01NCCCCCNS(=O)(=O)c1cccc2c1cccc2Cl
FormulaC15 H19 Cl N2 O2 S
NameN-(5-aminopentyl)-5-chloronaphthalene-1-sulfonamide
ChEMBL
DrugBank
ZINCZINC000002169539
PDB chain7uha Chain A Residue 201 [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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PDB7uha Drugging the Sarcomere, a Delicate Balance: Position of N-Terminal Charge of the Inhibitor W7.
ResolutionN/A
Binding residue
(original residue number in PDB)		F27 L41 M45 M60 E63 V64 M80 S84 V146 I148 M153
Binding residue
(residue number reindexed from 1)		F27 L41 M45 M60 E63 V64 M80 S84 V101 I103 M108
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005509 calcium ion binding
Cellular Component
GO:0005861 troponin complex

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Molecular Function
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Cellular Component
External links
PDB RCSB:7uha, PDBe:7uha, PDBj:7uha
PDBsum7uha
PubMed35649123
UniProtP19429;
P63316|TNNC1_HUMAN Troponin C, slow skeletal and cardiac muscles (Gene Name=TNNC1)

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