BIOPEP-UWM: Report

ID 3220
Name calpain inhibitor
sequence
EKLGERDDTIPPEYRELLEKKTGVACE
Function:
Inhibitor of calpain 2 (EC 3.4.22.53) (MEROPS ID: C02.002)
 
Number of residues
27
Activity code
cal2
Activity :
Calpain 2 inhibitor
Chemical mass 3119.4509 Monoisotopic mass 3117.5600
EC50 :
0.00 µM


Bibliographic data:
Authors
Huang J., Forsberg N. E.
Title
Role of calpain in skeletal-muscle protein degradation. Proc. Natl. Acad. Sci. USA, 95, 12100-12105 (1998)
Year Source
1998 Journal


Additional information:
BIOPEP-UWM database of bioactive peptides

SMILES: [H][C@](N)(CCC(O)=O)C(=O)N[C@@]([H])(CCCCN)C(=O)N[C@@]([H])(CC(C)C)C(=O)NCC(=O)N[C@@]([H])(CCC(O)=O)C(=O)N[C@@]([H])(CCCNC(N)=N)C(=O)N[C@@]([H])(CC(O)=O)C(=O)N[C@@]([H])(CC(O)=O)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N[C@@]([H])([C@@H](C)CC)C(=O)N1CCC[C@@]1([H])C(=O)N1CCC[C@@]1([H])C(=O)N[C@@]([H])(CCC(O)=O)C(=O)N[C@@]([H])(Cc1ccc(O)cc1)C(=O)N[C@@]([H])(CCCNC(N)=N)C(=O)N[C@@]([H])(CCC(O)=O)C(=O)N[C@@]([H])(CC(C)C)C(=O)N[C@@]([H])(CC(C)C)C(=O)N[C@@]([H])(CCC(O)=O)C(=O)N[C@@]([H])(CCCCN)C(=O)N[C@@]([H])(CCCCN)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)NCC(=O)N[C@@]([H])(C(C)C)C(=O)N[C@@]([H])(C)C(=O)N[C@@]([H])(CS)C(=O)N[C@@]([H])(CCC(O)=O)C(O)=O

InChI=1S/C134H220N36O47S/c1-14-68(10)105(166-129(213)107(71(13)172)168-124(208)90(60-103(190)191)163-123(207)89(59-102(188)189)162-114(198)79(29-22-52-144-134(141)142)152-115(199)80(37-43-97(178)179)148-94(174)61-145-110(194)85(55-64(2)3)158-113(197)75(25-15-18-48-135)149-109(193)74(138)36-42-96(176)177)131(215)170-54-24-31-93(170)130(214)169-53-23-30-92(169)126(210)156-83(40-46-100(184)185)118(202)161-88(58-72-32-34-73(173)35-33-72)122(206)153-78(28-21-51-143-133(139)140)112(196)154-82(39-45-99(182)183)117(201)159-87(57-66(6)7)121(205)160-86(56-65(4)5)120(204)155-81(38-44-98(180)181)116(200)150-76(26-16-19-49-136)111(195)151-77(27-17-20-50-137)119(203)167-106(70(12)171)127(211)146-62-95(175)165-104(67(8)9)128(212)147-69(11)108(192)164-91(63-218)125(209)157-84(132(216)217)41-47-101(186)187/h32-35,64-71,74-93,104-107,171-173,218H,14-31,36-63,135-138H2,1-13H3,(H,145,194)(H,146,211)(H,147,212)(H,148,174)(H,149,193)(H,150,200)(H,151,195)(H,152,199)(H,153,206)(H,154,196)(H,155,204)(H,156,210)(H,157,209)(H,158,197)(H,159,201)(H,160,205)(H,161,202)(H,162,198)(H,163,207)(H,164,192)(H,165,175)(H,166,213)(H,167,203)(H,168,208)(H,176,177)(H,178,179)(H,180,181)(H,182,183)(H,184,185)(H,186,187)(H,188,189)(H,190,191)(H,216,217)(H4,139,140,143)(H4,141,142,144)/t68-,69-,70+,71+,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,104-,105-,106-,107-/m0/s1

InChIKey=WHAXNZGGQBIOPZ-LQNGQQLBSA-N


Database reference: