Found 2 hits for monomerid = 228811 Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
UDP-3-O-(acryl)-glucosamine acryltransferase (LpxD)
(Escherichia coli (Enterobacteria)) | BDBM228811
(FITC-(βa)TNLYML-COOH | FITC-RJPXD33Δ6-CO...)Show SMILES CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)CCNC(=S)Nc1ccc(c(c1)C(O)=O)-c1c2ccc(O)cc2oc2cc(=O)ccc12)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(O)=O |r,wU:71.77,20.25,4.4,36.37,wD:28.33,8.17,77.81,(51.24,-12.65,;49.91,-13.42,;49.91,-14.96,;48.58,-15.73,;48.58,-17.27,;47.24,-18.04,;45.7,-17.27,;45.7,-15.73,;44.37,-18.04,;44.37,-19.58,;45.7,-20.35,;45.7,-21.89,;47.04,-22.66,;48.37,-21.89,;49.7,-22.66,;48.37,-20.35,;47.04,-19.58,;43.04,-17.27,;41.5,-18.04,;41.5,-19.58,;40.16,-17.27,;40.16,-15.73,;41.5,-14.96,;42.83,-15.73,;41.5,-13.42,;38.83,-18.04,;37.29,-17.27,;37.29,-15.73,;35.95,-18.04,;35.95,-19.58,;37.29,-20.35,;37.29,-21.89,;38.62,-19.58,;34.62,-17.27,;33.08,-18.04,;33.08,-19.58,;31.75,-17.27,;30.29,-17.97,;28.98,-17.22,;28.98,-15.68,;27.65,-17.99,;26.32,-17.22,;24.98,-17.99,;23.65,-17.22,;23.65,-15.68,;22.32,-17.99,;22.32,-19.53,;23.65,-20.3,;23.65,-21.84,;22.32,-22.61,;20.98,-21.84,;20.98,-20.3,;19.49,-22.24,;18.41,-21.15,;19.1,-23.73,;22.32,-24.15,;23.65,-24.92,;24.98,-24.15,;26.32,-24.92,;26.32,-26.46,;27.65,-27.23,;24.98,-27.23,;23.65,-26.46,;22.32,-27.23,;20.98,-26.46,;19.65,-27.23,;18.31,-26.46,;16.98,-27.23,;18.31,-24.92,;19.65,-24.15,;20.98,-24.92,;31.75,-15.73,;30.41,-14.96,;33.08,-14.96,;49.91,-18.04,;49.91,-19.58,;51.45,-17.27,;52.78,-18.04,;52.78,-19.58,;54.12,-20.35,;55.45,-19.58,;54.12,-21.89,;54.12,-17.27,;55.45,-18.04,;54.12,-15.73,)| Show InChI InChI=1S/C58H71N9O16S2/c1-28(2)21-41(52(75)64-42(23-31-7-10-33(69)11-8-31)53(76)62-40(18-20-85-6)51(74)66-44(57(81)82)22-29(3)4)63-54(77)43(27-47(59)72)65-55(78)50(30(5)68)67-48(73)17-19-60-58(84)61-32-9-14-36(39(24-32)56(79)80)49-37-15-12-34(70)25-45(37)83-46-26-35(71)13-16-38(46)49/h7-16,24-26,28-30,40-44,50,68-70H,17-23,27H2,1-6H3,(H2,59,72)(H,62,76)(H,63,77)(H,64,75)(H,65,78)(H,66,74)(H,67,73)(H,79,80)(H,81,82)(H2,60,61,84)/t30-,40+,41+,42+,43+,44+,50+/m1/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 3.60E+4 | n/a | n/a | n/a | 8.0 | n/a |
University of Michigan
| Assay Description
The fluorescence polarization assay was performed as previously described [Jenkins et al., ACS Chem. Biol., 7:1170-1177]. In 384-well black Costar pl... |
J Biol Chem 289: 15527-35 (2014)
Article DOI: 10.1074/jbc.M114.564278
BindingDB Entry DOI: 10.7270/Q2RV0MJP |
More data for this
Ligand-Target Pair | |
UDP-N-acetylglucosamine acryltransferase (LpxA)
(Escherichia coli (Enterobacteria)) | BDBM228811
(FITC-(βa)TNLYML-COOH | FITC-RJPXD33Δ6-CO...)Show SMILES CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)CCNC(=S)Nc1ccc(c(c1)C(O)=O)-c1c2ccc(O)cc2oc2cc(=O)ccc12)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(O)=O |r,wU:71.77,20.25,4.4,36.37,wD:28.33,8.17,77.81,(51.24,-12.65,;49.91,-13.42,;49.91,-14.96,;48.58,-15.73,;48.58,-17.27,;47.24,-18.04,;45.7,-17.27,;45.7,-15.73,;44.37,-18.04,;44.37,-19.58,;45.7,-20.35,;45.7,-21.89,;47.04,-22.66,;48.37,-21.89,;49.7,-22.66,;48.37,-20.35,;47.04,-19.58,;43.04,-17.27,;41.5,-18.04,;41.5,-19.58,;40.16,-17.27,;40.16,-15.73,;41.5,-14.96,;42.83,-15.73,;41.5,-13.42,;38.83,-18.04,;37.29,-17.27,;37.29,-15.73,;35.95,-18.04,;35.95,-19.58,;37.29,-20.35,;37.29,-21.89,;38.62,-19.58,;34.62,-17.27,;33.08,-18.04,;33.08,-19.58,;31.75,-17.27,;30.29,-17.97,;28.98,-17.22,;28.98,-15.68,;27.65,-17.99,;26.32,-17.22,;24.98,-17.99,;23.65,-17.22,;23.65,-15.68,;22.32,-17.99,;22.32,-19.53,;23.65,-20.3,;23.65,-21.84,;22.32,-22.61,;20.98,-21.84,;20.98,-20.3,;19.49,-22.24,;18.41,-21.15,;19.1,-23.73,;22.32,-24.15,;23.65,-24.92,;24.98,-24.15,;26.32,-24.92,;26.32,-26.46,;27.65,-27.23,;24.98,-27.23,;23.65,-26.46,;22.32,-27.23,;20.98,-26.46,;19.65,-27.23,;18.31,-26.46,;16.98,-27.23,;18.31,-24.92,;19.65,-24.15,;20.98,-24.92,;31.75,-15.73,;30.41,-14.96,;33.08,-14.96,;49.91,-18.04,;49.91,-19.58,;51.45,-17.27,;52.78,-18.04,;52.78,-19.58,;54.12,-20.35,;55.45,-19.58,;54.12,-21.89,;54.12,-17.27,;55.45,-18.04,;54.12,-15.73,)| Show InChI InChI=1S/C58H71N9O16S2/c1-28(2)21-41(52(75)64-42(23-31-7-10-33(69)11-8-31)53(76)62-40(18-20-85-6)51(74)66-44(57(81)82)22-29(3)4)63-54(77)43(27-47(59)72)65-55(78)50(30(5)68)67-48(73)17-19-60-58(84)61-32-9-14-36(39(24-32)56(79)80)49-37-15-12-34(70)25-45(37)83-46-26-35(71)13-16-38(46)49/h7-16,24-26,28-30,40-44,50,68-70H,17-23,27H2,1-6H3,(H2,59,72)(H,62,76)(H,63,77)(H,64,75)(H,65,78)(H,66,74)(H,67,73)(H,79,80)(H,81,82)(H2,60,61,84)/t30-,40+,41+,42+,43+,44+,50+/m1/s1 | PDB
UniProtKB/SwissProt
UniProtKB/TrEMBL
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 4.40E+3 | n/a | n/a | n/a | 8.0 | n/a |
University of Michigan
| Assay Description
The fluorescence polarization assay was performed as previously described [Jenkins et al., ACS Chem. Biol., 7:1170-1177]. In 384-well black Costar pl... |
J Biol Chem 289: 15527-35 (2014)
Article DOI: 10.1074/jbc.M114.564278
BindingDB Entry DOI: 10.7270/Q2RV0MJP |
More data for this
Ligand-Target Pair | |
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