eF-site ID 3vuh-A
PDB Code 3vuh
Chain A

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Title Crystal structure of a cysteine-deficient mutant M3 in MAP kinase JNK1
Classification TRANSFERASE/TRANSFERASE INHIBITOR
Compound Mitogen-activated protein kinase 8
Source (JIP1_HUMAN)
Sequence A:  DNNFYSVEIGDSTFTVLKRYQNLKPIGSGAQGIVCAAYDA
ILERNVAIKKLSRPFQNQTHAKRAYRELVLMKCVNHKNII
GLLNVFTPQKSLEEFQDVYIVMELMDANLSQVIQMELDHE
RMSYLLYQMLCGIKHLHSAGIIHRDLKPSNIVVKSDATLK
ILDFGLARTAGTSTPYVVTRYYRAPEVILGMGYKENVDIW
SVGCIMGEMIKGGVLFPGTDHIDQWNKVIEQLGTPSPEFM
KKLQPTVRTYVENRPKYAGYSFEKLFPDVLFPADSEHNKL
KASQARDLLSKMLVIDASKRISVDEALQHPYINVWYDPSE
AEAPPPKIPDKQLDEREHTIEEWKELIYKEVMDLE
Description


Functional site

1) chain A
residue 189
type
sequence R
description BINDING SITE FOR RESIDUE SO4 A 400
source : AC1

2) chain A
residue 192
type
sequence R
description BINDING SITE FOR RESIDUE SO4 A 400
source : AC1

3) chain A
residue 230
type
sequence H
description BINDING SITE FOR RESIDUE SO4 A 400
source : AC1

4) chain A
residue 255
type
sequence T
description BINDING SITE FOR RESIDUE SO4 A 400
source : AC1

5) chain A
residue 153
type
sequence K
description BINDING SITE FOR RESIDUE SO4 A 401
source : AC2

6) chain A
residue 155
type
sequence S
description BINDING SITE FOR RESIDUE SO4 A 401
source : AC2

7) chain A
residue 263
type
sequence R
description BINDING SITE FOR RESIDUE SO4 A 402
source : AC3

8) chain A
residue 263
type
sequence R
description BINDING SITE FOR RESIDUE SO4 A 402
source : AC3

9) chain A
residue 69
type
sequence R
description BINDING SITE FOR RESIDUE SO4 A 403
source : AC4

10) chain A
residue 72
type
sequence R
description BINDING SITE FOR RESIDUE SO4 A 403
source : AC4

11) chain A
residue 150
type
sequence R
description BINDING SITE FOR RESIDUE SO4 A 403
source : AC4

12) chain A
residue 174
type
sequence R
description BINDING SITE FOR RESIDUE SO4 A 403
source : AC4

13) chain A
residue 183
type
sequence T
description BINDING SITE FOR RESIDUE SO4 A 403
source : AC4

14) chain A
residue 38
type
sequence G
description BINDING SITE FOR RESIDUE SO4 A 404
source : AC5

15) chain A
residue 56
type
sequence K
description BINDING SITE FOR RESIDUE SO4 A 404
source : AC5

16) chain A
residue 57
type
sequence L
description BINDING SITE FOR RESIDUE SO4 A 404
source : AC5

17) chain A
residue 58
type
sequence S
description BINDING SITE FOR RESIDUE SO4 A 404
source : AC5

18) chain A
residue 66
type
sequence H
description BINDING SITE FOR RESIDUE SO4 A 404
source : AC5

19) chain A
residue 109
type
sequence E
description BINDING SITE FOR RESIDUE GOL A 405
source : AC6

20) chain A
residue 110
type
sequence L
description BINDING SITE FOR RESIDUE GOL A 405
source : AC6

21) chain A
residue 111
type
sequence M
description BINDING SITE FOR RESIDUE GOL A 405
source : AC6

22) chain A
residue 15
type
sequence I
description BINDING SITE FOR CHAIN F OF PEPTIDE FROM C-JUN-AMINO-TERMINAL KINASE-INTERACTING PROTEIN 1
source : AC7

23) chain A
residue 17
type
sequence D
description BINDING SITE FOR CHAIN F OF PEPTIDE FROM C-JUN-AMINO-TERMINAL KINASE-INTERACTING PROTEIN 1
source : AC7

24) chain A
residue 31
type
sequence P
description BINDING SITE FOR CHAIN F OF PEPTIDE FROM C-JUN-AMINO-TERMINAL KINASE-INTERACTING PROTEIN 1
source : AC7

25) chain A
residue 33
type
sequence G
description BINDING SITE FOR CHAIN F OF PEPTIDE FROM C-JUN-AMINO-TERMINAL KINASE-INTERACTING PROTEIN 1
source : AC7

26) chain A
residue 34
type
sequence S
description BINDING SITE FOR CHAIN F OF PEPTIDE FROM C-JUN-AMINO-TERMINAL KINASE-INTERACTING PROTEIN 1
source : AC7

27) chain A
residue 39
type
sequence I
description BINDING SITE FOR CHAIN F OF PEPTIDE FROM C-JUN-AMINO-TERMINAL KINASE-INTERACTING PROTEIN 1
source : AC7

28) chain A
residue 40
type
sequence V
description BINDING SITE FOR CHAIN F OF PEPTIDE FROM C-JUN-AMINO-TERMINAL KINASE-INTERACTING PROTEIN 1
source : AC7

29) chain A
residue 121
type
sequence M
description BINDING SITE FOR CHAIN F OF PEPTIDE FROM C-JUN-AMINO-TERMINAL KINASE-INTERACTING PROTEIN 1
source : AC7

30) chain A
residue 127
type
sequence R
description BINDING SITE FOR CHAIN F OF PEPTIDE FROM C-JUN-AMINO-TERMINAL KINASE-INTERACTING PROTEIN 1
source : AC7

31) chain A
residue 130
type
sequence Y
description BINDING SITE FOR CHAIN F OF PEPTIDE FROM C-JUN-AMINO-TERMINAL KINASE-INTERACTING PROTEIN 1
source : AC7

32) chain A
residue 161
type
sequence S
description BINDING SITE FOR CHAIN F OF PEPTIDE FROM C-JUN-AMINO-TERMINAL KINASE-INTERACTING PROTEIN 1
source : AC7

33) chain A
residue 162
type
sequence D
description BINDING SITE FOR CHAIN F OF PEPTIDE FROM C-JUN-AMINO-TERMINAL KINASE-INTERACTING PROTEIN 1
source : AC7

34) chain A
residue 163
type
sequence A
description BINDING SITE FOR CHAIN F OF PEPTIDE FROM C-JUN-AMINO-TERMINAL KINASE-INTERACTING PROTEIN 1
source : AC7

35) chain A
residue 324
type
sequence W
description BINDING SITE FOR CHAIN F OF PEPTIDE FROM C-JUN-AMINO-TERMINAL KINASE-INTERACTING PROTEIN 1
source : AC7

36) chain A
residue 329
type
sequence E
description BINDING SITE FOR CHAIN F OF PEPTIDE FROM C-JUN-AMINO-TERMINAL KINASE-INTERACTING PROTEIN 1
source : AC7

37) chain A
residue 147-159
type prosite
sequence IIHRDLKPSNIVV
description PROTEIN_KINASE_ST Serine/Threonine protein kinases active-site signature. IiHrDLKpsNIVV
source prosite : PS00108

38) chain A
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

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

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

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

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

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


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