5MRD Chain A
3-phosphoinositide-dependent protein kinase 1 (PDPK1)
Active — 99.8%DFG-inαC-inATPlike · ATP
Resolution
1.41 Å
R-value
0.142
Predicted activity confidence99.8%
Structure info
Alternate conformationA
Missing atoms4
Missing residues0
Salt bridge (KinCore)Saltbr-in
Sequence info
PDB sequence
SKRPEDFKFGKILGEGSFSTVVLARELATSREYAIKIVEKRHVNKENKIPYVQREKDVMSRLDHPFFVKLYFCFQDDEKLYFGLSYAKNGELLKYIRKIGSFDETCTRFYTAEIVSALEYLHGKGIIHRDLKPENILLNEDMHIQITDFGTAKVLSPESKQARANFVGTAQYVSPELLTEKSACKSSDLWALGCIIYQLVAGLPPFRAGNEGLIFAKIIKLEYDFPEKFFPKARDLVEKLLVLDATKRLGCEEMEGYGPLKAHPFFESVTWENLHQQTPPKLT
UniProt reference sequence
FKFGKILGEGSFSTVVLARELATSREYAIKILEKRHIIKENKVPYVTRERDVMSRLDHPFFVKLYFTFQDDEKLYFGLSYAKNGELLKYIRKIGSFDETCTRFYTAEIVSALEYLHGKGIIHRDLKPENILLNEDMHIQITDFGTAKVLSPESKQARANSFVGTAQYVSPELLTEKSACKSSDLWALGCIIYQLVAGLPPFRAGNEYLIFQKIIKLEYDFPEKFFPKARDLVEKLLVLDATKRLGCEEMEGYGPLKAHPFF
Aligned reference sequence
FKFG----------------KILGEGS----------------FSTVVLARE--LA------------------------------------TSREYAIKILE--KRHIIKENK-------------------------VPYVTRERDVMSRL--------------------------DHPFFVKLYFTFQDDE--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KLYFGLSYAKN--------------GELLKYIRK--IG-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SFDETCTRFYTAEIVSALEYLHGK---------------------------------------------GIIHRDL-----KPENILLNE--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DMHIQITDFGTAKVLSPESKQ--ARA-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------NSFVGTAQYVSPELLTE--------------------------------KSAC-KSSDLWALGCIIYQLVAG-----------------LPPFRA--------------------------------------------------GNEYLIFQKIIKL--EYDFPEKFF------------------------------------------------------------------------------------------------------PKARDLVEKLLVLDATKRLG--CEEMEG------YGPLKAHPFF
Shaded segments mark residues present in the UniProt reference but not resolved in this structure.
Projected alignment
FKFG----------------KILGEGS----------------FSTVVLARE--LA------------------------------------TSREYAIKIVE--KRHVNKENK-------------------------IPYVQREKDVMSRL--------------------------DHPFFVKLYFCFQDDE--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KLYFGLSYAKN--------------GELLKYIRK--IG-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SFDETCTRFYTAEIVSALEYLHGK---------------------------------------------GIIHRDL-----KPENILLNE--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DMHIQITDFGTAKVLSPESKQ--ARA-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------N-FVGTAQYVSPELLTE--------------------------------KSAC-KSSDLWALGCIIYQLVAG-----------------LPPFRA--------------------------------------------------GNEGLIFAKIIKL--EYDFPEKFF------------------------------------------------------------------------------------------------------PKARDLVEKLLVLDATKRLG--CEEMEG------YGPLKAHPFF
Activation segment
DFGTAKVLSPESKQ--ARA-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------N-FVGTAQYVSPE
Binding pocket
KILGEGSFSTVVLYAIKIVYVQREKDVMSRLDPFFVKLYFCYFGLSYAKNGELLKYIRKYLHGKGIIHRDLKPENILLITDFGTA
Ligand info
Orthosteric ligand
ATP
Allosteric ligand
S26
Ligand typeATPlike
Consensus conformation
DFG conformationin
αC-helix conformationin
Predicted activityactive
KinaDB — structure detail · data from Browse_each_pdb_structure.csv · PDB 5MRD, Chain A