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BDBM226116 ELPPEERLLRAIFGEK::MT1

SMILES: CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCCN)C(O)=O

InChI Key: InChIKey=XBTSXFPOISJZLL-JSTVPZNISA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 226116   
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
RNA polymerase sigma factor SigB (σB)


(Mycobacterium tuberculosis)
BDBM226116
PNG
(ELPPEERLLRAIFGEK | MT1)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCCN)C(O)=O
Show InChI InChI=1S/C86H141N23O25/c1-10-48(8)69(81(130)105-60(43-50-20-12-11-13-21-50)72(121)95-44-64(110)97-54(28-32-66(113)114)75(124)102-57(84(133)134)22-14-15-35-87)107-70(119)49(9)96-73(122)52(23-16-36-93-85(89)90)99-78(127)58(40-45(2)3)104-79(128)59(41-46(4)5)103-74(123)53(24-17-37-94-86(91)92)98-76(125)55(29-33-67(115)116)100-77(126)56(30-34-68(117)118)101-80(129)62-25-18-38-108(62)83(132)63-26-19-39-109(63)82(131)61(42-47(6)7)106-71(120)51(88)27-31-65(111)112/h11-13,20-21,45-49,51-63,69H,10,14-19,22-44,87-88H2,1-9H3,(H,95,121)(H,96,122)(H,97,110)(H,98,125)(H,99,127)(H,100,126)(H,101,129)(H,102,124)(H,103,123)(H,104,128)(H,105,130)(H,106,120)(H,107,119)(H,111,112)(H,113,114)(H,115,116)(H,117,118)(H,133,134)(H4,89,90,93)(H4,91,92,94)/t48-,49-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63-,69-/m0/s1
UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 139n/an/an/an/an/a



Indian Institute of Science



Assay Description
The experiments were conducted using the Octet Red System (Forte bio, MenloPark, CA). Biotinylated peptides were immobilized on kinetics grade Strept...


Biochemistry 56: 2209-2218 (2017)


Article DOI: 10.1021/acs.biochem.6b01267
BindingDB Entry DOI: 10.7270/Q2736PR7
More data for this
Ligand-Target Pair