Reaction Details  Report a problem with these data
Cell Reactant:
Caseinolytic protein C1 (ClpC1)
Syringe Reactant:
BDBM213240
Meas. Tech.:
Enzyme Inhibition
Entry Date.:
2017-02-21
ΔG°:
-44.2300±n/a (kJ/mole)
pH:
7.5000±0.0000
Temperature:
298.1500±0.0000 (K)
ΔH° :
-40.6500±0.3100 (kJ/mole)
ΔS° :
0.0120±0.0000 (kJ/mole-K)
Citation
 Vasudevan, D; Rao, SP; Noble, CG Structural basis of mycobacterial inhibition by cyclomarin A J Biol Chem 288:30883-91 (2013) [PubMed]  Article 
Cell React
Name:
ATP-dependent Clp protease ATP-binding subunit ClpC1
Synonyms:
CLPC1_MYCTU | clpC1 | Caseinolytic protein C1 (ClpC1)
Type:
Protein
Mol. Mass.:
93541.69
Organism:
Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
Description:
P9WPC9
Residue:
848
Sequence:
MFERFTDRARRVVVLAQEEARMLNHNYIGTEHILLGLIHEGEGVAAKSLESLGISLEGVRSQVEEIIGQGQQAPSGHIPFTPRAKKVLELSLREALQLGHNYIGTEHILLGLIREGEGVAAQVLVKLGAELTRVRQQVIQLLSGYQGKEAAEAGTGGRGGESGSPSTSLVLDQFGRNLTAAAMEGKLDPVIGREKEIERVMQVLSRRTKNNPVLIGEPGVGKTAVVEGLAQAIVHGEVPETLKDKQLYTLDLGSLVAGSRYRGDFEERLKKVLKEINTRGDIILFIDELHTLVGAGAAEGAIDAASILKPKLARGELQTIGATTLDEYRKYIEKDAALERRFQPVQVGEPTVEHTIEILKGLRDRYEAHHRVSITDAAMVAAATLADRYINDRFLPDKAIDLIDEAGARMRIRRMTAPPDLREFDEKIAEARREKESAIDAQDFEKAASLRDREKTLVAQRAEREKQWRSGDLDVVAEVDDEQIAEVLGNWTGIPVFKLTEAETTRLLRMEEELHKRIIGQEDAVKAVSKAIRRTRAGLKDPKRPSGSFIFAGPSGVGKTELSKALANFLFGDDDALIQIDMGEFHDRFTASRLFGAPPGYVGYEEGGQLTEKVRRKPFSVVLFDEIEKAHQEIYNSLLQVLEDGRLTDGQGRTVDFKNTVLIFTSNLGTSDISKPVGLGFSKGGGENDYERMKQKVNDELKKHFRPEFLNRIDDIIVFHQLTREEIIRMVDLMISRVAGQLKSKDMALVLTDAAKALLAKRGFDPVLGARPLRRTIQREIEDQLSEKILFEEVGPGQVVTVDVDNWDGEGPGEDAVFTFTGTRKPPAEPDLAKAGAHSAGGPEPAAR
  
Syringe React
Name:
BDBM213240
Synonyms:
Cyclomarin A1 (CymA1)
Type:
Small organic molecule
Emp. Form.:
n/a
Mol. Mass.:
n/a
SMILES:
CO[C@H](c1ccccc1)[C@@H]1NC(=O)[C@H](C)NC(=O)[C@H](C[C@@H](C)CO)N(C)C(=O)[C@H]([C@H](O)c2cn(C(C)(C)[C@@H](O)CNCCCN)c3ccccc23)NC(=O)[C@H]([C@H](C)C=C(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](C(C)C)NC1=O
Structure:
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