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Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'Type IV secretion-like conjugative transfer relaxase protein TraI'   
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
Type IV secretion-like conjugative transfer relaxase protein TraI


(Escherichia coli (strain SMS-3-5 / SECEC))
BDBM50478336
PNG
(Imidobisphosphate | Imidodiphosphate)
Show SMILES OP(O)(=O)NP(O)(O)=O
Show InChI InChI=1S/H5NO6P2/c2-8(3,4)1-9(5,6)7/h(H5,1,2,3,4,5,6,7)
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
PDB
UniChem
Article
PubMed
2n/an/an/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli F plasmid TraI relaxase Y16F mutant assessed as oriT ssDNA cleavage by competitive inhibition assay


Proc Natl Acad Sci U S A 104: 12282-7 (2007)


Article DOI: 10.1073/pnas.0702760104
BindingDB Entry DOI: 10.7270/Q2PK0JXD
More data for this
Ligand-Target Pair
Type IV secretion-like conjugative transfer relaxase protein TraI


(Escherichia coli (strain SMS-3-5 / SECEC))
BDBM50478336
PNG
(Imidobisphosphate | Imidodiphosphate)
Show SMILES OP(O)(=O)NP(O)(O)=O
Show InChI InChI=1S/H5NO6P2/c2-8(3,4)1-9(5,6)7/h(H5,1,2,3,4,5,6,7)
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
PDB
UniChem
Article
PubMed
2.70n/an/an/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli F plasmid TraI relaxase Y16F mutant assessed as oriT ssDNA cleavage by uncompetitive inhibition assay


Proc Natl Acad Sci U S A 104: 12282-7 (2007)


Article DOI: 10.1073/pnas.0702760104
BindingDB Entry DOI: 10.7270/Q2PK0JXD
More data for this
Ligand-Target Pair
Type IV secretion-like conjugative transfer relaxase protein TraI


(Escherichia coli (strain SMS-3-5 / SECEC))
BDBM50216172
PNG
((Dichloro-phosphono-methyl)-phosphonic acid | CHEM...)
Show SMILES OP(O)(=O)C(Cl)(Cl)P(O)(O)=O
Show InChI InChI=1S/CH4Cl2O6P2/c2-1(3,10(4,5)6)11(7,8)9/h(H2,4,5,6)(H2,7,8,9)
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
PC cid
PC sid
UniChem

Patents

Article
PubMed
3n/an/an/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli F plasmid TraI relaxase Y16F mutant assessed as oriT ssDNA cleavage by competitive inhibition assay


Proc Natl Acad Sci U S A 104: 12282-7 (2007)


Article DOI: 10.1073/pnas.0702760104
BindingDB Entry DOI: 10.7270/Q2PK0JXD
More data for this
Ligand-Target Pair
Type IV secretion-like conjugative transfer relaxase protein TraI


(Escherichia coli (strain SMS-3-5 / SECEC))
BDBM50115102
PNG
((1-Hydroxy-1-phosphono-ethyl)-phosphonic acid | CH...)
Show SMILES CC(O)(P(O)(O)=O)P(O)(O)=O
Show InChI InChI=1S/C2H8O7P2/c1-2(3,10(4,5)6)11(7,8)9/h3H,1H3,(H2,4,5,6)(H2,7,8,9)
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Article
PubMed
3n/an/an/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli F plasmid TraI relaxase Y16F mutant assessed as oriT ssDNA cleavage by competitive inhibition assay


Proc Natl Acad Sci U S A 104: 12282-7 (2007)


Article DOI: 10.1073/pnas.0702760104
BindingDB Entry DOI: 10.7270/Q2PK0JXD
More data for this
Ligand-Target Pair
Type IV secretion-like conjugative transfer relaxase protein TraI


(Escherichia coli (strain SMS-3-5 / SECEC))
BDBM50162816
PNG
(CHEMBL180570 | Medronic acid | Methylene diphsphon...)
Show SMILES OP(O)(=O)CP(O)(O)=O
Show InChI InChI=1S/CH6O6P2/c2-8(3,4)1-9(5,6)7/h1H2,(H2,2,3,4)(H2,5,6,7)
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
3n/an/an/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli F plasmid TraI relaxase Y16F mutant assessed as oriT ssDNA cleavage by competitive inhibition assay


Proc Natl Acad Sci U S A 104: 12282-7 (2007)


Article DOI: 10.1073/pnas.0702760104
BindingDB Entry DOI: 10.7270/Q2PK0JXD
More data for this
Ligand-Target Pair