PDB entry 4l7c
View 4l7c on RCSB PDB site
Description: Structure of keap1 kelch domain with 2-{[(1S)-2-{[(1R,2S)-2-(1H-tetrazol-5-yl)cyclohexyl]carbonyl}-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}-1H-isoindole-1,3(2H)-dione
Class: transcription/inhibitor
Keywords: STRESS SENSOR, KELCH DOMAIN, KELCH REPEAT MOTIF, BETA-PROPELLER, NRF2, PROTEIN-SMALL MOLECULE COMPLEX, TRANSCRIPTION-INHIBITOR complex
Deposited on
2013-06-13, released
2014-02-19
The last revision prior to the SCOPe 2.07 freeze date was dated
2014-04-23, with a file datestamp of
2014-04-18.
Experiment type: XRAY
Resolution: 2.4 Å
R-factor: 0.266
AEROSPACI score: 0.22
(click here for full SPACI score report)
Chains and heterogens:
- Chain 'A':
Compound: Kelch-like ECH-associated protein 1
Species: Homo sapiens [TaxId:9606]
Gene: KEAP1, INRF2, KIAA0132, KLHL19
Database cross-references and differences (RAF-indexed):
- Uniprot Q14145 (Start-291)
- engineered mutation (36)
- expression tag (292-293)
Domains in SCOPe 2.07: d4l7ca1, d4l7ca2 - Chain 'B':
Compound: Kelch-like ECH-associated protein 1
Species: Homo sapiens [TaxId:9606]
Gene: KEAP1, INRF2, KIAA0132, KLHL19
Database cross-references and differences (RAF-indexed):
- Uniprot Q14145 (Start-291)
- engineered mutation (36)
- expression tag (292-293)
Domains in SCOPe 2.07: d4l7cb1, d4l7cb2 - Chain 'C':
Compound: Kelch-like ECH-associated protein 1
Species: Homo sapiens [TaxId:9606]
Gene: KEAP1, INRF2, KIAA0132, KLHL19
Database cross-references and differences (RAF-indexed):
- Uniprot Q14145 (Start-291)
- engineered mutation (36)
- expression tag (292-293)
Domains in SCOPe 2.07: d4l7cc1, d4l7cc2 - Heterogens: 1VW, ACT, HOH
PDB Chain Sequences:
- Chain 'A':
Sequence, based on SEQRES records: (download)
>4l7cA (A:)
mghapkvgrliytaggyfrqslsyleaynpsdgtwldladlqvprsglagcvvggllyav
ggrnnspdgntdssaldcynpmtnqwspcapmsvprnrigvgvidghiyavggshgcihh
nsveryeperdewhlvapmltrrigvgvavlnrllyavggfdgtnrlnsaecyypernew
rmitamntirsgagvcvlhnciyaaggydgqdqlnsverydvetetwtfvapmkhrrsal
gitvhqgriyvlggydghtfldsvecydpdtdtwsevtrmtsgrsgvgvavtlehhhhhh
Sequence, based on observed residues (ATOM records): (download)
>4l7cA (A:)
rliytaggyfrqslsyleaynpsdgtwldladlqvprsglagcvvggllyavggrnnspd
gntdssaldcynpmtnqwspcapmsvprnrigvgvidghiyavggshgcihhnsveryep
erdewhlvapmltrrigvgvavlnrllyavggfdgtnrlnsaecyypernewrmitamnt
irsgagvcvlhnciyaaggydgqdqlnsverydvetetwtfvapmkhrrsalgitvhqgr
iyvlggydghtfldsvecydpdtdtwsevtrmtsgrsgvgvavtle
- Chain 'B':
Sequence, based on SEQRES records: (download)
>4l7cB (B:)
mghapkvgrliytaggyfrqslsyleaynpsdgtwldladlqvprsglagcvvggllyav
ggrnnspdgntdssaldcynpmtnqwspcapmsvprnrigvgvidghiyavggshgcihh
nsveryeperdewhlvapmltrrigvgvavlnrllyavggfdgtnrlnsaecyypernew
rmitamntirsgagvcvlhnciyaaggydgqdqlnsverydvetetwtfvapmkhrrsal
gitvhqgriyvlggydghtfldsvecydpdtdtwsevtrmtsgrsgvgvavtlehhhhhh
Sequence, based on observed residues (ATOM records): (download)
>4l7cB (B:)
rliytaggyfrqslsyleaynpsdgtwldladlqvprsglagcvvggllyavggrnnspd
gntdssaldcynpmtnqwspcapmsvprnrigvgvidghiyavggshgcihhnsveryep
erdewhlvapmltrrigvgvavlnrllyavggfdgtnrlnsaecyypernewrmitamnt
irsgagvcvlhnciyaaggydgqdqlnsverydvetetwtfvapmkhrrsalgitvhqgr
iyvlggydghtfldsvecydpdtdtwsevtrmtsgrsgvgvavtle
- Chain 'C':
Sequence, based on SEQRES records: (download)
>4l7cC (C:)
mghapkvgrliytaggyfrqslsyleaynpsdgtwldladlqvprsglagcvvggllyav
ggrnnspdgntdssaldcynpmtnqwspcapmsvprnrigvgvidghiyavggshgcihh
nsveryeperdewhlvapmltrrigvgvavlnrllyavggfdgtnrlnsaecyypernew
rmitamntirsgagvcvlhnciyaaggydgqdqlnsverydvetetwtfvapmkhrrsal
gitvhqgriyvlggydghtfldsvecydpdtdtwsevtrmtsgrsgvgvavtlehhhhhh
Sequence, based on observed residues (ATOM records): (download)
>4l7cC (C:)
rliytaggyfrqslsyleaynpsdgtwldladlqvprsglagcvvggllyavggrnnspd
gntdssaldcynpmtnqwspcapmsvprnrigvgvidghiyavggshgcihhnsveryep
erdewhlvapmltrrigvgvavlnrllyavggfdgtnrlnsaecyypernewrmitamnt
irsgagvcvlhnciyaaggydgqdqlnsverydvetetwtfvapmkhrrsalgitvhqgr
iyvlggydghtfldsvecydpdtdtwsevtrmtsgrsgvgvavtle