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Structure of PDB 8ve6 Chain D Binding Site BS01

Receptor Information
>8ve6 Chain D (length=115) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KCPLMVKVLDAVRGSPAINVAVHVFRKAADDTWEPFASGKTSESGELHGL
TTEEEFVEGIYKVEIDTKSYWKALGISPFHEHAEVVFTANDSGPRRYTIA
ALLSPYSYSTTAVVT
Ligand information
Ligand IDP2C
InChIInChI=1S/C13H9Cl2NO5/c14-9-5-7(6-10(15)12(9)20-21-19)16-11-4-2-1-3-8(11)13(17)18/h1-6,16,19H,(H,17,18)
InChIKeySNAMTVTZDPUVRA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0c1ccc(c(c1)C(=O)O)Nc2cc(c(c(c2)Cl)OOO)Cl
ACDLabs 10.04Clc1cc(cc(Cl)c1OOO)Nc2ccccc2C(=O)O
CACTVS 3.341OOOc1c(Cl)cc(Nc2ccccc2C(O)=O)cc1Cl
FormulaC13 H9 Cl2 N O5
Name2-[(3,5-DICHLORO-4-TRIOXIDANYLPHENYL)AMINO]BENZOIC ACID;
2-[3,5-DICHLORO-4-(2-{2-[2(2-MERCAPTOETHOXY)ETHOXY]ETHOXY}ETHOXY)PHENYLAMINO]BENZOIC ACID
ChEMBL
DrugBankDB04756
ZINCZINC000014881299
PDB chain8ve6 Chain B Residue 201 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Traceback (most recent call last):
  File "/usr/lib64/python3.6/gzip.py", line 325, in flush
    self.fileobj.write(self.compress.flush(zlib_mode))
OSError: [Errno 28] No space left on device

During handling of the above exception, another exception occurred:

Traceback (most recent call last):
  File "/var/www/html/BioLiP/pdb.cgi", line 1703, in <module>
    pubmed,uniprot=display_interaction(pdbid,asym_id,bs,title)
  File "/var/www/html/BioLiP/pdb.cgi", line 1220, in display_interaction
    fout.close()
  File "/usr/lib64/python3.6/gzip.py", line 319, in close
    myfileobj.close()
OSError: [Errno 28] No space left on device