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Substance Name: Grendel protein, recombinant
RN: 141304-55-4
InChIKey: MPDSVFMNDZTGQD-OGWLCLCSSA-N

Note

  • Computer designed protein; a four-helical membrane anchor, ready for fusion to water-soluble functional domains; contains four chains.

Molecular Formula

  • C134-H205-N27-O30-S

Molecular Weight

  • 2706.3185
 
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Names and Synonyms

Name of Substance

  • Grendel protein, recombinant

Systematic Name

  • Glycine,L-prolyl-L-alpha-glutamyl-L-tryptophyl-L-isoleucyl-L-tryptophyl-L-leucyl-L-alanyl-L-leucylglycyl-L-threonyl-L-alanyl-L-leucyl-L-methionylglycyl-L-leucyl-L-leucyl-L-threonyl-L-leucyl-L-tyrosyl-L-phenylalanyl-L-leucyl-L-valyl-L-lysyl-

Registry Numbers

CAS Registry Number

  • 141304-55-4

System Generated Number

  • 0141304554

Structure Descriptors

InChI

1S/C134H205N27O30S/c1-24-77(18)111(160-130(187)105(63-85-65-138-90-40-31-29-38-88(85)90)155-120(177)93(47-48-108(167)168)145-119(176)91-42-34-51-136-91)132(189)157-104(62-84-64-137-89-39-30-28-37-87(84)89)127(184)150-97(55-71(6)7)121(178)142-78(19)114(171)148-95(53-69(2)3)118(175)140-67-107(166)158-112(80(21)162)133(190)143-79(20)115(172)149-98(56-72(8)9)123(180)146-94(49-52-192-23)117(174)139-66-106(165)144-96(54-70(4)5)122(179)151-101(59-75(14)15)129(186)161-113(81(22)163)134(191)156-99(57-73(10)11)124(181)153-103(61-83-43-45-86(164)46-44-83)126(183)154-102(60-82-35-26-25-27-36-82)125(182)152-100(58-74(12)13)128(185)159-110(76(16)17)131(188)147-92(41-32-33-50-135)116(173)141-68-109(169)170/h25-31,35-40,43-46,64-65,69-81,91-105,110-113,136-138,162-164H,24,32-34,41-42,47-63,66-68,135H2,1-23H3,(H,139,174)(H,140,175)(H,141,173)(H,142,178)(H,143,190)(H,144,165)(H,145,176)(H,146,180)(H,147,188)(H,148,171)(H,149,172)(H,150,184)(H,151,179)(H,152,182)(H,153,181)(H,154,183)(H,155,177)(H,156,191)(H,157,189)(H,158,166)(H,159,185)(H,160,187)(H,161,186)(H,167,168)(H,169,170)/t77-,78-,79-,80+,81+,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,110-,111-,112-,113-/m0/s1

InChIKey

MPDSVFMNDZTGQD-OGWLCLCSSA-N

Smiles

CC[C@H](C)[C@@H](C(=O)N[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc3ccc(cc3)O)C(=O)N[C@@H](Cc4ccccc4)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)NC(=O)[C@H](Cc5c[nH]c6c5cccc6)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]7CCCN7