Structure of PDB 8s3a Chain F Binding Site BS01

Receptor Information
>8s3a Chain F (length=413) Species: 3880 (Medicago truncatula) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
NAMNALVATNRNFQRASRILGLDSKLEKSLLIPYREIKVECTIPKDDGSL
VSYVGFRIQHDNARGPMKGGIRYHPEVDPDEVNALAQLMTWKTAVVDIPY
GGAKGGIGCNPKDLSISELERLTRVFTQKIHDLIGIHRDVPAPDMGTNSQ
TMAWILDEYSKFHGHSPAVVTGKPIDLGGSLGREAATGLGVVFATEALFA
EYGKSISDMTFAIQGFGNVGTWAAKAIFERGGKVVAVSDINGAISNPNGI
DIAALLKHKAGNGSLKDFSGGDAMNPNDLLVHDCDVLIPCALGGVLNKEN
ANDVKAKFIIEAANHPTDPDADEILSKKGVIILPDVYANAGGVTVSYFEW
VQNIQGFMWDEEKVNQELKRYMTKAFNDIKANCKTHNCDLRMGAFTLGLN
RVARATLLRGWEA
Ligand information
Ligand IDPDC
InChIInChI=1S/C7H5NO4/c9-6(10)4-2-1-3-5(8-4)7(11)12/h1-3H,(H,9,10)(H,11,12)
InChIKeyWJJMNDUMQPNECX-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04O=C(O)c1nc(C(=O)O)ccc1
CACTVS 3.341OC(=O)c1cccc(n1)C(O)=O
OpenEye OEToolkits 1.5.0c1cc(nc(c1)C(=O)O)C(=O)O
FormulaC7 H5 N O4
NamePYRIDINE-2,6-DICARBOXYLIC ACID;
DIPICOLINIC ACID
ChEMBLCHEMBL284104
DrugBankDB04267
ZINCZINC000000105246
PDB chain8s3a Chain F Residue 601 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB8s3a Legume-type glutamate dehydrogenase: Structure, activity, and inhibition studies.
Resolution1.85 Å
Binding residue
(original residue number in PDB)		K66 M87 K90 K102 A140 P141 D142 R181 N312 S344
Binding residue
(residue number reindexed from 1)		K68 M89 K92 K104 A142 P143 D144 R183 N314 S346
Annotation score1
External links