Target Binding Site Detail

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Target General Information
Ligand General Information
Drug Binding Sites of Target
References
Target General Information  Top
Target ID T62912 Target Info
Target Name Corticotropin-lipotropin (POMC)
Synonyms Pro-opiomelanocortin
Target Type Literature-reported Target
Gene Name POMC
UniProt ID
COLI_HUMAN
Ligand General Information  Top
Ligand Name Carboxymethyl-coenzyme A Ligand Info
Canonical SMILES CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSCC(=O)O)O
InChI 1S/C23H38N7O18P3S/c1-23(2,18(35)21(36)26-4-3-13(31)25-5-6-52-8-14(32)33)9-45-51(42,43)48-50(40,41)44-7-12-17(47-49(37,38)39)16(34)22(46-12)30-11-29-15-19(24)27-10-28-20(15)30/h10-12,16-18,22,34-35H,3-9H2,1-2H3,(H,25,31)(H,26,36)(H,32,33)(H,40,41)(H,42,43)(H2,24,27,28)(H2,37,38,39)/t12-,16-,17-,18+,22-/m1/s1
InChIKey OBUOSIHPWVNVJN-GRFIIANRSA-N
PubChem Compound ID 444878
Drug Binding Sites of Target  Top
PDB ID: 4XNH      Crystal structure of yeast N-terminal acetyltransferase NatE (IP6) in complex with a bisubstrate
Method X-ray diffraction Resolution 2.10 Å Mutation No [1]
PDB Sequence
SYSMEH
Residue
Distance (Å)
SER1
1.173
Residue
Distance (Å)
TYR2
4.350
PDB ID: 4XPD      Crystal structure of yeast N-terminal acetyltransferase NatE (ppGpp) in complex with a bisubstrate
Method X-ray diffraction Resolution 2.81 Å Mutation No [2]
PDB Sequence
SYSMEH
Residue
Distance (Å)
SER1
1.325
Residue
Distance (Å)
TYR2
4.357
PDB ID: 4Y49      Crystal structure of yeast N-terminal acetyltransferase (ppGpp) NatE in complex with a bisubstrate
Method X-ray diffraction Resolution 3.95 Å Mutation No [3]
PDB Sequence
SYSMEH
Residue
Distance (Å)
SER1
3.452
Residue
Distance (Å)
References  Top
REF 1 Crystal structure of yeast N-terminal acetyltransferase NatE (IP6) in complex with a bisubstrate
REF 2 Crystal structure of yeast N-terminal acetyltransferase NatE (ppGpp) in complex with a bisubstrate
REF 3 Crystal structure of yeast N-terminal acetyltransferase (ppGpp) NatE in complex with a bisubstrate

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