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BDBM7953 (2S)-2-amino-3-(1H-imidazol-4-yl)propanoic acid::Histidine::Imidazole C-4(5) deriv. 5::L-2-Amino-3-(4-imidazolyl)propionic acid::L-Histidine

SMILES: N[C@@H](Cc1cnc[nH]1)C(O)=O

InChI Key: InChIKey=HNDVDQJCIGZPNO-YFKPBYRVSA-N

Data: 1 KI  1 Kd  1 ITC

PDB links: 1 PDB ID matches this monomer.

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 7953   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM7953
PNG
((2S)-2-amino-3-(1H-imidazol-4-yl)propanoic acid | ...)
Show SMILES N[C@@H](Cc1cnc[nH]1)C(O)=O
Show InChI InChI=1S/C6H9N3O2/c7-5(6(10)11)1-4-2-8-3-9-4/h2-3,5H,1,7H2,(H,8,9)(H,10,11)/t5-/m0/s1
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PC sid
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Similars

Article
PubMed
4.40E+6n/an/an/an/an/an/an/an/a



Probiodrug AG



Assay Description
QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...


J Biol Chem 278: 49773-9 (2003)


Article DOI: 10.1074/jbc.M309077200
BindingDB Entry DOI: 10.7270/Q2513WDS
More data for this
Ligand-Target Pair
Histidine-binding periplasmic protein (HisJ)


(Escherichia coli (Enterobacteria))
BDBM7953
PNG
((2S)-2-amino-3-(1H-imidazol-4-yl)propanoic acid | ...)
Show SMILES N[C@@H](Cc1cnc[nH]1)C(O)=O
Show InChI InChI=1S/C6H9N3O2/c7-5(6(10)11)1-4-2-8-3-9-4/h2-3,5H,1,7H2,(H,8,9)(H,10,11)/t5-/m0/s1
PDB

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CHEBI
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PC cid
PC sid
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UniChem

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Article
PubMed
n/an/an/a 114n/an/an/a7.030



University of Calgary



Assay Description
All ITC experiments were performed using a Microcal VP-ITC microcalorimeter (GE Healthcare). All samples were prepared in a buffer containing 20 mM H...


J Biol Chem 288: 31409-22 (2013)


Article DOI: 10.1074/jbc.M113.490441
BindingDB Entry DOI: 10.7270/Q2862F9B
More data for this
Ligand-Target Pair

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 7953
Cell (A)Syringe (B)Cell
Links
Syringe
Links
Cell + Syr
Links
ΔG°
kcal/mole
-TΔS°
kcal/mole
ΔH°
kcal/mole
log KpHTemp
°C
Histidine-binding periplasmic protein (HisJ)

(Escherichia coli (Enterobacteria))
BDBM7953
JPEG
((2S)-2-amino-3-(1H-imidazol-4-yl)propanoic acid | ...)
GoogleScholar
PDB
CHEBI
DrugBank
MMDB
PC cid
PC sid
PDB
-8.395.50-14.66.05730



University of Calgary





J Biol Chem 288: 31409-22 (2013)