Ki Summary

Reaction Details

Report a problem with these data

Target

Replication protein A 70 kDa DNA-binding subunit

Ligand

BDBM50006724

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_1336209 (CHEMBL3241316)

7400±n/a nM

Citation

Frank, AO; Vangamudi, B; Feldkamp, MD; Souza-Fagundes, EM; Luzwick, JW; Cortez, D; Olejniczak, ET; Waterson, AG; Rossanese, OW; Chazin, WJ; Fesik, SW Discovery of a potent stapled helix peptide that binds to the 70N domain of replication protein A. J Med Chem57:2455-61 (2014) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Replication protein A 70 kDa DNA-binding subunit

Name:

Replication protein A 70 kDa DNA-binding subunit

Synonyms:

Type:

Enzyme

Mol. Mass.:

68139.43

Organism:

Homo sapiens (Human)

Description:

P27694

Residue:

616

Sequence:

MVGQLSEGAIAAIMQKGDTNIKPILQVINIRPITTGNSPPRYRLLMSDGLNTLSSFMLAT
QLNPLVEEEQLSSNCVCQIHRFIVNTLKDGRRVVILMELEVLKSAEAVGVKIGNPVPYNE
GLGQPQVAPPAPAASPAASSRPQPQNGSSGMGSTVSKAYGASKTFGKAAGPSLSHTSGGT
QSKVVPIASLTPYQSKWTICARVTNKSQIRTWSNSRGEGKLFSLELVDESGEIRATAFNE
QVDKFFPLIEVNKVYYFSKGTLKIANKQFTAVKNDYEMTFNNETSVMPCEDDHHLPTVQF
DFTGIDDLENKSKDSLVDIIGICKSYEDATKITVRSNNREVAKRNIYLMDTSGKVVTATL
WGEDADKFDGSRQPVLAIKGARVSDFGGRSLSVLSSSTIIANPDIPEAYKLRGWFDAEGQ
ALDGVSISDLKSGGVGGSNTNWKTLYEVKSENLGQGDKPDYFSSVATVVYLRKENCMYQA
CPTQDCNKKVIDQQNGLYRCEKCDTEFPNFKYRMILSVNIADFQENQWVTCFQESAEAIL
GQNAAYLGELKDKNEQAFEEVFQNANFRSFIFRVRVKVETYNDESRIKATVMDVKPVDYR
EYGRRLVMSIRRSALM

BDBM50006724

n/a

Name

BDBM50006724

Synonyms:

CHEMBL3236543

Type

Small organic molecule

Emp. Form.

C99H121N17O24S

Mol. Mass.

1965.185

SMILES

CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@]1(C)CCC\C=C/CCC[C@@](C)(NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=S)Nc2ccc(c(c2)C(O)=O)-c2c3ccc(O)cc3oc3cc(=O)ccc23)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N1)C(O)=O |r,wU:58.61,4.3,73.77,38.41,121.129,48.51,13.13,107.116,wD:113.121,24.25,53.56,8.8,129.137,62.65,c:46,(67.85,-15.26,;66.52,-14.5,;66.52,-12.97,;65.19,-15.26,;65.19,-16.8,;63.86,-17.57,;62.53,-16.8,;62.53,-15.27,;61.21,-17.56,;61.21,-19.11,;59.87,-16.79,;58.55,-17.56,;58.55,-19.1,;57.21,-16.79,;57.21,-15.26,;58.55,-14.49,;59.88,-15.27,;61.21,-14.5,;61.21,-12.97,;59.88,-12.19,;58.55,-12.96,;55.89,-17.56,;54.55,-16.79,;54.55,-15.26,;53.22,-17.55,;53.22,-19.1,;54.55,-19.85,;55.95,-19.24,;56.98,-20.37,;56.21,-21.71,;56.69,-23.17,;55.65,-24.31,;54.15,-24,;53.68,-22.53,;54.7,-21.39,;51.89,-16.78,;50.57,-17.55,;50.57,-19.09,;49.23,-16.78,;50.32,-15.68,;48.46,-15.44,;49.23,-14.11,;48.46,-12.78,;49.22,-11.45,;48.46,-10.12,;35.53,-13.38,;35.15,-14.86,;33.66,-15.26,;33.28,-16.76,;32.5,-15.42,;31.96,-17.53,;30.62,-16.75,;30.62,-15.23,;29.29,-17.53,;29.29,-19.06,;27.96,-16.75,;26.63,-17.53,;26.63,-19.06,;25.3,-16.75,;23.97,-17.52,;22.64,-16.74,;22.64,-15.22,;21.32,-17.52,;21.32,-19.05,;22.64,-19.82,;22.64,-21.36,;23.96,-22.13,;25.29,-21.36,;25.3,-19.83,;23.97,-19.06,;19.99,-16.74,;18.66,-17.52,;18.66,-19.05,;17.32,-16.74,;17.32,-15.21,;18.66,-14.45,;19.99,-15.21,;18.66,-12.91,;15.99,-17.52,;14.6,-16.69,;14.62,-15.08,;13.2,-17.48,;11.81,-16.66,;10.42,-17.44,;9.03,-16.61,;9.05,-14.99,;10.46,-14.21,;11.85,-15.04,;10.89,-12.66,;12.45,-12.25,;9.75,-11.51,;7.65,-14.16,;6.25,-14.95,;6.23,-16.55,;4.81,-17.34,;3.43,-16.52,;2,-17.3,;3.46,-14.9,;4.87,-14.11,;4.88,-12.5,;6.31,-11.73,;6.32,-10.11,;7.74,-9.31,;7.75,-7.68,;9.12,-10.15,;9.09,-11.76,;7.68,-12.55,;25.3,-15.22,;23.97,-14.46,;26.63,-14.46,;34.61,-17.54,;34.61,-19.07,;35.94,-16.76,;37.27,-17.54,;37.27,-19.07,;38.6,-19.83,;39.92,-19.07,;38.6,-21.38,;38.6,-16.76,;38.6,-15.24,;39.93,-17.54,;41.26,-16.77,;41.26,-15.24,;42.59,-14.47,;43.92,-15.24,;42.59,-12.94,;42.59,-17.55,;42.59,-19.08,;43.92,-16.77,;45.25,-17.55,;45.25,-19.08,;46.58,-19.84,;46.58,-21.39,;45.24,-22.16,;47.9,-22.15,;46.58,-16.77,;46.58,-15.25,;47.91,-17.55,;66.52,-17.57,;67.85,-16.8,;66.52,-19.11,)|

Structure