Structure of PDB 6d0k Chain C Binding Site BS01

Receptor Information
>6d0k Chain C (length=90) Species: 32630 (synthetic construct) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SSVPTKLEVVAATPTSLLISWDASSSSVSYYRITYGETGGNSPVQEFTVP
GSSSTATISGLSPGVDYTITVYAHGWLQWYMSPISINYQT
Ligand information
Ligand IDMHA
InChIInChI=1S/C6H10N2O5/c7-4(9)1-8(2-5(10)11)3-6(12)13/h1-3H2,(H2,7,9)(H,10,11)(H,12,13)
InChIKeyQZTKDVCDBIDYMD-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341NC(=O)CN(CC(O)=O)CC(O)=O
OpenEye OEToolkits 1.5.0C(C(=O)N)N(CC(=O)O)CC(=O)O
ACDLabs 10.04O=C(O)CN(CC(=O)N)CC(=O)O
FormulaC6 H10 N2 O5
Name(CARBAMOYLMETHYL-CARBOXYMETHYL-AMINO)-ACETIC ACID;
N-(2-ACETAMIDO)IMINODIACETIC ACID
ChEMBL
DrugBankDB02810
ZINCZINC000002545127
PDB chain6d0k Chain C Residue 101 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6d0k A CLC-type F-/H+antiporter in ion-swapped conformations.
Resolution3.35 Å
Binding residue
(original residue number in PDB)		Y38 F50 T60 S62
Binding residue
(residue number reindexed from 1)		Y35 F47 T57 S59
Annotation score1
External links