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PubMed code 1868065

Compile data set for download or QSAR
Found 5 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Carbamoyl-phosphate synthase (H353N)


(Escherichia coli (strain K12))
BDBM93010
PNG
(Glutamine Analogue, 2)
Show SMILES [NH3+]C(CCC(=O)NO)C([O-])=O
Show InChI InChI=1S/C5H10N2O4/c6-3(5(9)10)1-2-4(8)7-11/h3,11H,1-2,6H2,(H,7,8)(H,9,10)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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PC sid
UniChem

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PubMed
9.00E+3n/an/an/an/an/an/a7.5n/a



Texas A&M University



Assay Description
The rate of carbamoyl phosphate synthesis was determined by use of a coupled enzyme assay with ornithine transcarbamoylase.


Citation and Details
More data for this
Ligand-Target Pair
Carbamoyl-phosphate synthase (H353N)


(Escherichia coli (strain K12))
BDBM93009
PNG
(Glutamine Analogue, 1)
Show SMILES NC(=O)CCC([NH3+])C([O-])=O
Show InChI InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem

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PubMed
5.40E+4n/an/an/an/an/an/a7.5n/a



Texas A&M University



Assay Description
The rate of carbamoyl phosphate synthesis was determined by use of a coupled enzyme assay with ornithine transcarbamoylase.


Citation and Details
More data for this
Ligand-Target Pair
Carbamoyl-phosphate synthase (H353N)


(Escherichia coli (strain K12))
BDBM93011
PNG
(Glutamine Analogue, 3)
Show SMILES NNC(=O)CCC([NH3+])C([O-])=O
Show InChI InChI=1S/C5H11N3O3/c6-3(5(10)11)1-2-4(9)8-7/h3H,1-2,6-7H2,(H,8,9)(H,10,11)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PubMed
3.40E+5n/an/an/an/an/an/a7.5n/a



Texas A&M University



Assay Description
The rate of carbamoyl phosphate synthesis was determined by use of a coupled enzyme assay with ornithine transcarbamoylase.


Citation and Details
More data for this
Ligand-Target Pair
Carbamoyl-phosphate synthase (H353N)


(Escherichia coli (strain K12))
BDBM93013
PNG
(Glutamine Analogue, 5)
Show SMILES COC(=O)CCC([NH3+])C([O-])=O
Show InChI InChI=1S/C6H11NO4/c1-11-5(8)3-2-4(7)6(9)10/h4H,2-3,7H2,1H3,(H,9,10)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem

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PubMed
2.50E+7n/an/an/an/an/an/a7.5n/a



Texas A&M University



Assay Description
The rate of carbamoyl phosphate synthesis was determined by use of a coupled enzyme assay with ornithine transcarbamoylase.


Citation and Details
More data for this
Ligand-Target Pair
Carbamoyl-phosphate synthase (H353N)


(Escherichia coli (strain K12))
BDBM93012
PNG
(Glutamine Analogue, 4)
Show SMILES [NH3+]C(CCC([O-])=O)C([O-])=O
Show InChI InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PubMed
2.80E+7n/an/an/an/an/an/a7.5n/a



Texas A&M University



Assay Description
The rate of carbamoyl phosphate synthesis was determined by use of a coupled enzyme assay with ornithine transcarbamoylase.


Citation and Details
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%