eF-site ID 5vio-C
PDB Code 5vio
Chain C

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Title Crystal structure of ASK1 kinase domain with a potent inhibitor (analog 13)
Classification TRANSFERASE/TRANSFERASE INHIBITOR
Compound Mitogen-activated protein kinase kinase kinase 5
Source Homo sapiens (Human) (M3K5_HUMAN)
Sequence C:  LLEYDYEYDENGDRVVLGKGTYGIVYAGRDLSNQVRIAIK
EIPERDSRYSQPLHEEIALHKHLKHKNIVQYLGSFSENGF
IKIFMEQVPGGSLSALLRSKWGPLKDNEQTIGFYTKQILE
GLKYLHDNQIVHRDIKGDNVLINTYSGVLKISDFGTSKRL
AGINPCTETFTGTLQYMAPEIIDKGPRGYGKAADIWSLGC
TIIEMATGKPPFYELGEPQAAMFKVGMFKVHPEIPESMSA
EAKAFILKCFEPDPDKRACANDLLVDEFLKV
Description


Functional site

1) chain C
residue 814
type
sequence Y
description binding site for residue 9E4 D 4000
source : AC3

2) chain C
residue 709
type BINDING
sequence K
description
source Swiss-Prot : SWS_FT_FI3

3) chain C
residue 803
type ACT_SITE
sequence D
description Proton acceptor => ECO:0000255|PROSITE-ProRule:PRU00159, ECO:0000255|PROSITE-ProRule:PRU10027
source Swiss-Prot : SWS_FT_FI1

4) chain C
residue 686
type BINDING
sequence L
description BINDING => ECO:0000255|PROSITE-ProRule:PRU00159
source Swiss-Prot : SWS_FT_FI2

5) chain C
residue 718
type MOD_RES
sequence Y
description Phosphotyrosine => ECO:0000269|PubMed:16407264
source Swiss-Prot : SWS_FT_FI4

6) chain C
residue 813
type MOD_RES
sequence T
description Phosphothreonine; by autocatalysis => ECO:0000269|PubMed:17937911
source Swiss-Prot : SWS_FT_FI5

7) chain C
residue 842
type MOD_RES
sequence T
description Phosphothreonine; by autocatalysis => ECO:0000269|PubMed:17937911
source Swiss-Prot : SWS_FT_FI5

8) chain C
residue 838
type MOD_RES
sequence T
description Phosphothreonine; by autocatalysis, MELK and MAP3K6 => ECO:0000269|PubMed:11920685, ECO:0000269|PubMed:17210579, ECO:0000269|PubMed:17937911, ECO:0000269|PubMed:18948261, ECO:0000269|PubMed:19590015, ECO:0000269|PubMed:23102700
source Swiss-Prot : SWS_FT_FI6


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