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8A6F

Small molecule stabilizer (compound 8) for C-RAF and 14-3-3

Entity
Entity IDChain IDDescriptionTypeChain lengthFormula weightNumber of moleculesDB Name (Accession)Biological sourceDescriptive keywords
1A
(A)
14-3-3 protein sigmapolymer23626542.91UniProt (P31947)
Pfam (PF00244)
Homo sapiens (human)Epithelial cell marker protein 1,Stratifin
2B
(P)
RAF proto-oncogene serine/threonine-protein kinasepolymer111206.21UniProt (P04049)Homo sapiensProto-oncogene c-RAF,cRaf,Raf-1
3C
(A)
CHLORIDE IONnon-polymer35.51Chemie (CL)
4D, E
(A)
MAGNESIUM IONnon-polymer24.32Chemie (MG)
5F
(A)
1-[4-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-oxidanyl-piperidin-1-yl]-3-[2-(dimethylamino)ethyldisulfanyl]propan-1-onenon-polymer471.01Chemie (O56)
6G, H
(A, P)
waterwater18.0332Chemie (HOH)
Sequence modifications
A: 1 - 231 (UniProt: P31947)
PDBExternal DatabaseDetails
Gly -4-expression tag
Ala -3-expression tag
Met -2-expression tag
Gly -1-expression tag
Ser 0-expression tag
P: 255 - 264 (UniProt: P04049)
PDBExternal DatabaseDetails
Nh2 265-amidation
Sequence viewer
Contents of the asymmetric unit
PolymersNumber of chains2
Total formula weight27749.1
Non-Polymers*Number of molecules4
Total formula weight555.1
All*Total formula weight28304.2
*Water molecules are not included.

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PDB entries from 2024-12-25

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