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PDB code 1CGP

Compile Data Set for Download or QSAR

Identical Ligands in BindingDB

Found 1 hit Enzyme Inhibition Constant Data   
Target
(Institution)
LigandTarget
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
cyclic AMP receptor protein

  (196/205 = 96%)
(Vibrio cholerae O1 biovar El Tor str. N16961)
BDBM10851
PNG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@@H]2COP(O)(=O)O[C@H]2[C@H]1O
Show InChI InChI=1S/C10H12N5O6P/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(16)7-4(20-10)1-19-22(17,18)21-7/h2-4,6-7,10,16H,1H2,(H,17,18)(H2,11,12,13)/t4-,6-,7-,10-/m1/s1
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
Purchase

KEGG
PC cid
PC sid
UniChem

Similars

AffyNet 
PCBioAssay
n/an/a 1.30E+5n/an/an/an/an/an/a



Southern Research Specialized Biocontainment Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)

More data for this
Ligand-Target Pair

Identical Ligands in BindingDB

Found 12 hits Isothermal Titration Calorimetry Data
Cell (A)Syringe (B)Cell
Links
Syringe
Links
Cell + Syr
Links
ΔG°
kJ/mole
-TΔS°
kJ/mole
ΔH°
kJ/mole
log KpHTemp
°C
cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-32.2-57.225.55.617.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-30.5-23.0-7.905.437.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-30.1-20.9-9.205.267.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-30.1-83.251.55.267.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-29.3-16.4-11.35.267.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-28.9-20.6-8.405.087.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-28.9-59.030.15.087.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-28.5-16.4-12.14.917.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-28.5-9.54-19.24.917.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-27.6-62.034.34.917.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-27.6-68.6414.917.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-25.5-29.22.904.567.8025


TBA



Details of this binding reaction


Similar Ligands in BindingDB*

Found 12 hits Isothermal Titration Calorimetry Data
Cell (A)Syringe (B)Cell
Links
Syringe
Links
Cell + Syr
Links
ΔG°
kJ/mole
-TΔS°
kJ/mole
ΔH°
kJ/mole
log KpHTemp
°C
cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-32.2-57.225.55.617.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-30.5-23.0-7.905.437.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-30.1-20.9-9.205.267.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-30.1-83.251.55.267.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-29.3-16.4-11.35.267.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-28.9-20.6-8.405.087.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-28.9-59.030.15.087.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-28.5-16.4-12.14.917.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-28.5-9.54-19.24.917.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-27.6-62.034.34.917.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-27.6-68.6414.917.8025


TBA



Details of this binding reaction

cAMP-activated global transcriptional regulator CRP  (205/205 = 100%)

(Escherichia coli)
BDBM10851
JPEG
((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)
GoogleScholar
PDB
CHEBI
KEGG
PC cid
PC sid
-25.5-29.22.904.567.8025


TBA



Details of this binding reaction

Search BindingMOAD for More Affinity Data:

* indicates data uncertainty>20%
* 0.9 Tanimoto similarity
Identities from BLAST output