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9R9M

Crystal Structure of human MLH1 C-terminal domain with cyclic peptide (2S)-N-[(6S,9S,12S,15S,18S,26aR)-12-(4-aminobutyl)-18-benzyl-21-(2-carbamoylethyl)-9-(hydroxymethyl)- 15-[(4-hydroxyphenyl)methyl]-1,7,10,13,16,19,22-heptaoxo-hexacosahydropyrrolo[2,1-c]1,4,7,10,13,16,19-heptaazacyclotetracosan-6-yl]-2-[(2S)-2-acetamidopropanamido]-3-methylbutanamide

This is a non-PDB format compatible entry.
Entity
Entity IDChain IDDescriptionTypeChain lengthFormula weightNumber of moleculesDB Name (Accession)Biological sourceDescriptive keywords
1A, B
(A, B)
DNA mismatch repair protein Mlh1polymer26730607.82UniProt (P40692)Homo sapiens (human)MutL protein homolog 1
2C
(I)
Cyclic peptide 1polymer101080.31synthetic construct
3D
(C)
Cyclic peptide 2polymer91028.21synthetic construct
4E, F, G, H, I...
(A, B)
1,2-ETHANEDIOLnon-polymer62.110Chemie (EDO)
5L, M, N, O, U...
(A, B)
CALCIUM IONnon-polymer40.16Chemie (CA)
PubChem (271)
6P, R, S
(B)
ACETATE IONnon-polymer59.03Chemie (ACT)
PubChem (175)
7AA, X, Y, Z
(C, A, B, I)
waterwater18.0190Chemie (HOH)
Sequence modifications
A, B: 486 - 751 (UniProt: P40692)
PDBExternal DatabaseDetails
Gly 485-expression tag
Sequence viewer
Contents of the asymmetric unit
PolymersNumber of chains4
Total formula weight63324.1
Non-Polymers*Number of molecules19
Total formula weight1038.3
All*Total formula weight64362.4
*Water molecules are not included.

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PDB entries from 2026-07-08

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