eF-site ID 2g01-B
PDB Code 2g01
Chain B

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Title Pyrazoloquinolones as Novel, Selective JNK1 inhibitors
Classification TRANSFERASE
Compound Mitogen-activated protein kinase 8
Source null (JIP1_HUMAN)
Sequence B:  NFYSVEIGDSTFTVLKRYQNLKPIGSGAQGIVCAAYDAIL
ERNVAIKKLSRPFQNQTHAKRAYRELVLMKCVNHKNIIGL
LNVFTPQKSLEEFQDVYIVMELMDANLCQVIQMELDHERM
SYLLYQMLCGIKHLHSAGIIHRDLKPSNIVVKSDCTLKIL
DFGLARTAGTSFMMEPEVVTRYYRAPEVILGMGYKENVDL
WSVGCIMGEMVCHKILFPGRDYIDQWNKVIEQLGTPCPEF
MKKLQPTVRTYVENRPKYAGYSFEKLFPDVLFPADSEHNK
LKASQARDLLSKMLVIDASKRISVDEALQHPYINVWYDPS
EAEAPPPKIPDKQLDEREHTIEEWKELIYKEVMDLEH
Description


Functional site

1) chain B
residue 255
type
sequence T
description BINDING SITE FOR RESIDUE SO4 A 501
source : AC1

2) chain B
residue 189
type
sequence R
description BINDING SITE FOR RESIDUE SO4 B 701
source : AC3

3) chain B
residue 192
type
sequence R
description BINDING SITE FOR RESIDUE SO4 B 701
source : AC3

4) chain B
residue 68
type
sequence K
description BINDING SITE FOR RESIDUE SO4 B 801
source : AC4

5) chain B
residue 69
type
sequence R
description BINDING SITE FOR RESIDUE SO4 B 801
source : AC4

6) chain B
residue 72
type
sequence R
description BINDING SITE FOR RESIDUE SO4 B 801
source : AC4

7) chain B
residue 150
type
sequence R
description BINDING SITE FOR RESIDUE SO4 B 801
source : AC4

8) chain B
residue 174
type
sequence R
description BINDING SITE FOR RESIDUE SO4 B 801
source : AC4

9) chain B
residue 108
type
sequence M
description BINDING SITE FOR RESIDUE 73Q B 1001
source : AC6

10) chain B
residue 110
type
sequence L
description BINDING SITE FOR RESIDUE 73Q B 1001
source : AC6

11) chain B
residue 111
type
sequence M
description BINDING SITE FOR RESIDUE 73Q B 1001
source : AC6

12) chain B
residue 112
type
sequence D
description BINDING SITE FOR RESIDUE 73Q B 1001
source : AC6

13) chain B
residue 113
type
sequence A
description BINDING SITE FOR RESIDUE 73Q B 1001
source : AC6

14) chain B
residue 114
type
sequence N
description BINDING SITE FOR RESIDUE 73Q B 1001
source : AC6

15) chain B
residue 158
type
sequence V
description BINDING SITE FOR RESIDUE 73Q B 1001
source : AC6

16) chain B
residue 168
type
sequence L
description BINDING SITE FOR RESIDUE 73Q B 1001
source : AC6

17) chain B
residue 151
type ACT_SITE
sequence D
description Proton acceptor => ECO:0000255|PROSITE-ProRule:PRU00159, ECO:0000255|PROSITE-ProRule:PRU10027
source Swiss-Prot : SWS_FT_FI1

18) chain B
residue 32
type BINDING
sequence I
description BINDING => ECO:0000255|PROSITE-ProRule:PRU00159
source Swiss-Prot : SWS_FT_FI2

19) chain B
residue 55
type BINDING
sequence K
description BINDING => ECO:0000255|PROSITE-ProRule:PRU00159
source Swiss-Prot : SWS_FT_FI2

20) chain B
residue 116
type MOD_RES
sequence C
description S-nitrosocysteine => ECO:0000250|UniProtKB:P49185
source Swiss-Prot : SWS_FT_FI3

21) chain B
residue 183
type MOD_RES
sequence E
description Phosphothreonine; by MAP2K7 => ECO:0000269|PubMed:11062067
source Swiss-Prot : SWS_FT_FI4

22) chain B
residue 185
type MOD_RES
sequence E
description Phosphotyrosine; by MAP2K4 => ECO:0000269|PubMed:11062067
source Swiss-Prot : SWS_FT_FI5


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