4A55

crystal structure of p110alpha in complex with ish2 of p85alpha and the inhibitor pik-108

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 204
  • Norm. En. per Res.: -2.855
• Hub Node: A(1)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-B	-23.8607	-74.6768	-483.888	-582.4255	204	30	6	20934	5	68	78

Interface residues

• A-B: ALA423A, ALA483B, ALA486B, ALA53A, ALA553B, ALA77A, ARG461B, ARG465B, ARG481B, ARG503B, ARG523B, ARG534B, ARG542B, ARG54A, ARG557B, ARG562B, ARG574B, ARG577B, ARG79A, ARG949A, ASN28A, ASN345A, ASN347A, ASN453B, ASN465A, ASN467A, ASN488B, ASN527B, ASN564B, ASN595B, ASN677A, ASP350A, ASP454A, ASP464B, ASP529B, ASP548B, ASP560B, ASP569B, ASP843A, CYS24A, CYS407A, CYS420A, CYS498B, GLN457B, GLN475B, GLN478B, GLN497B, GLN499B, GLN501B, GLN522B, GLN572B, GLN60A, GLN721A, GLN75A, GLN96A, GLU127A, GLU23A, GLU453A, GLU468B, GLU469A, GLU476B, GLU485B, GLU489B, GLU495B, GLU496B, GLU502B, GLU507B, GLU520B, GLU537B, GLU558B, GLU596B, GLU76A, GLU78A, GLU80A, GLU950A, GLY12A, GLY29A, GLY451A, GLY8A, GLY946A, HIS1047A, HIS1048A, HIS14A, HIS450A, HIS526B, HIS59A, HIS676A, ILE102A, ILE31A, ILE348A, ILE351A, ILE354A, ILE406A, ILE477B, ILE484B, ILE491B, ILE493B, ILE509B, ILE521B, ILE524B, ILE535B, ILE538B, ILE559B, ILE566B, ILE571B, LEU21A, LEU25A, LEU26A, LEU422A, LEU449B, LEU452A, LEU455A, LEU466B, LEU531B, LEU545B, LEU549B, LEU570B, LEU581B, LEU58A, LEU598B, LEU61A, LEU62A, LEU94A, LEU99A, LYS100A, LYS468A, LYS480B, LYS492B, LYS506B, LYS511B, LYS530B, LYS532B, LYS55A, LYS561B, LYS567B, LYS575B, LYS593B, LYS678A, LYS942A, LYS943A, LYS944A, LYS948A, MET30A, MET479B, MET525B, MET563B, PHE456B, PHE487B, PHE494B, PHE512B, PHE945A, PHE95A, PHE98A, PRO27A, PRO421A, PRO447A, PRO449A, PRO466A, PRO471A, PRO568B, PRO57A, PRO5A, PRO97A, SER408A, SER460B, SER474B, SER505B, SER533B, SER541B, SER565B, SER6A, SER72A, SER7A, THR33A, THR470A, THR471B, THR482B, THR490B, THR500B, THR74A, TRP11A, TRP424A, TRP446A, TRP597B, TYR343A, TYR463B, TYR467B, TYR470B, TYR504B, TYR508B, TYR528B, TYR556B, TYR56A, TYR68A, TYR947A, VAL101A, VAL22A, VAL32A, VAL344A, VAL346A, VAL409A, VAL448A, VAL71A, VAL73A