Structure of PDB 6z28 Chain A Binding Site BS02

Receptor Information
>6z28 Chain A (length=323) Species: 2026 (Thermoactinomyces vulgaris) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DFPSYDSGYHNYNEMVNKINTVASNYPNIVKKFSIGKSYEGRELWAVKIS
DNVGTDENEPEVLYTALHHAREHLTVEMALYTLDLFTQNYNLDSRITNLV
NNREIYIVFNINPDGGEYDISSGSYKSWRKNRQPNSGSSYVGTDLNRNYG
YKWGCCGGSSGSPSSETYRGRSAFSAPETAAMRDFINSRVVGGKQQIKTL
ITFHTYSELILYPYGYTYTDVPSDMTQDDFNVFKTMANTMAQTNGYTPQQ
ASDNYITDGDMTDWAYGQHKIFAFTFEMYPTSYNPGFYPPDEVIGRETSR
NKEAVLYVAEKADCPYSVIGKSC
Ligand information
Ligand ID3K0
InChIInChI=1S/C5H10N2O6S/c6-14(12,13)7-3(5(10)11)1-2-4(8)9/h3,7H,1-2H2,(H,8,9)(H,10,11)(H2,6,12,13)/t3-/m0/s1
InChIKeyZYYFXKZXQCQRTJ-VKHMYHEASA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.9.2C(CC(=O)O)[C@@H](C(=O)O)NS(=O)(=O)N
CACTVS 3.385N[S](=O)(=O)N[C@@H](CCC(O)=O)C(O)=O
OpenEye OEToolkits 1.9.2C(CC(=O)O)C(C(=O)O)NS(=O)(=O)N
ACDLabs 12.01O=S(=O)(NC(C(=O)O)CCC(=O)O)N
CACTVS 3.385N[S](=O)(=O)N[CH](CCC(O)=O)C(O)=O
FormulaC5 H10 N2 O6 S
NameN-sulfamoyl-L-glutamic acid
ChEMBL
DrugBank
ZINC
PDB chain6z28 Chain A Residue 402 [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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PDB6z28 CARBOXYPEPTIDASE T MUTANT L254N WITH WITH N-SULFAMOYL-L-GLUT
Resolution2.3 Å
Binding residue
(original residue number in PDB)		H69 E72 R129 N146 R147 H204 Y255 D260 E277
Binding residue
(residue number reindexed from 1)		H69 E72 R129 N146 R147 H204 Y255 D260 E277
Annotation score1
Enzymatic activity
Catalytic site (original residue number in PDB) H69 E72 R129 H204 E277
Catalytic site (residue number reindexed from 1) H69 E72 R129 H204 E277
Enzyme Commision number 3.4.17.18: carboxypeptidase T.
Gene Ontology
Molecular Function
GO:0004181 metallocarboxypeptidase activity
GO:0008270 zinc ion binding
Biological Process
GO:0006508 proteolysis

View graph for
Molecular Function
View graph for
Biological Process
External links
PDB RCSB:6z28, PDBe:6z28, PDBj:6z28
PDBsum6z28
PubMed
UniProtP29068|CBPT_THEVU Carboxypeptidase T (Gene Name=cpt)

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