2CLQ Chain B
Mitogen-activated protein kinase kinase kinase 5 (MAP3K5)
Inactive — 0.3%DFG-outαC-inType1 · STU
Resolution
2.3 Å
R-value
0.204
Predicted activity confidence0.3%
Structure info
Alternate conformationB
Missing atoms32
Missing residues0
Salt bridge (KinCore)Saltbr-none
Sequence info
PDB sequence
LLEYDYEYDENGDRVVLGKGTYGIVYAGRDLSNQVRIAIKEIPERSQPLHEEIALHKHLKHKNIVQYLGSFSENGFIKIFMEQVPGGSLSALLRSKWGPLKDNEQTIGFYTKQILEGLKYLHDNQIVHRDIKGDNVLINTYSGVLKISDFGTSKRLAFTGTLQYMAPEIIDKGPRGYGKAADIWSLGCTIIEMATGKPPFYELGEPQAAMFKVGMFKVHPEIPESMSAEAKAFILKCFEPDPDKRACANDLLVDEFLKV
UniProt reference sequence
YDYEYDENGDRVVLGKGTYGIVYAGRDLSNQVRIAIKEIPERDSRYSQPLHEEIALHKHLKHKNIVQYLGSFSENGFIKIFMEQVPGGSLSALLRSKWGPLKDNEQTIGFYTKQILEGLKYLHDNQIVHRDIKGDNVLINTYSGVLKISDFGTSKRLAGINPCTETFTGTLQYMAPEIIDKGPRGYGKAADIWSLGCTIIEMATGKPPFYELGEPQAAMFKVGMFKVHPEIPESMSAEAKAFILKCFEPDPDKRACANDLLVDEFL
Aligned reference sequence
YDYE--YDENGDR-------VVLGKGT----------------YGIVYAGRD--LS------------------------------------NQVRIAIKEIP--ERDSRY----------------------------SQPLHEEIALHKHL--------------------------KHKNIVQYLGSFSENG--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------FIKIFMEQVPG--------------GSLSALLRS--KWGPL----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KDNEQTIGFYTKQILEGLKYLHDN---------------------------------------------QIVHRDI-----KGDNVLINT--Y-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SGVLKISDFGTSKRLAGINPC--T---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ETFTGTLQYMAPEIIDK--GP----------------------------RGYG-KAADIWSLGCTIIEMATG-----------------KPPFYE--L-----------------------------------------------GEPQAAMFKVGMF--KVHPEIPESMS----------------------------------------------------------------------------------------------------AEAKAFILKCFEPDPDKRAC--------------ANDLLVDEFL
Shaded segments mark residues present in the UniProt reference but not resolved in this structure.
Projected alignment
YDYE--YDENGDR-------VVLGKGT----------------YGIVYAGRD--LS------------------------------------NQVRIAIKEIP--ER--------------------------------SQPLHEEIALHKHL--------------------------KHKNIVQYLGSFSENG--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------FIKIFMEQVPG--------------GSLSALLRS--KWGPL----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KDNEQTIGFYTKQILEGLKYLHDN---------------------------------------------QIVHRDI-----KGDNVLINT--Y-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SGVLKISDFGTSKRLA-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------FTGTLQYMAPEIIDK--GP----------------------------RGYG-KAADIWSLGCTIIEMATG-----------------KPPFYE--L-----------------------------------------------GEPQAAMFKVGMF--KVHPEIPESMS----------------------------------------------------------------------------------------------------AEAKAFILKCFEPDPDKRAC--------------ANDLLVDEFL
Activation segment
DFGTSKRLA-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------FTGTLQYMAPE
Binding pocket
VVLGKGTYGIVYAIAIKEIPLHEEIALHKHLKKNIVQYLGSKIFMEQVPGGSLSALLRSYLHDNQIVHRDIKGDNVLIISDFGTS
Ligand info
Orthosteric ligand
STU
Allosteric ligand
None
Ligand typeType1
Consensus conformation
DFG conformationout
αC-helix conformationin
Predicted activityinactive
KinaDB — structure detail · data from Browse_each_pdb_structure.csv · PDB 2CLQ, Chain B