2V3S

structural insights into the recognition of substrates and activators by the osr1 kinase

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 38
  • Norm. En. per Res.: -6.7597
• Hub Node: A(2)

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	-18.5566	-22.399	-65.8685	-106.8242	49	4	3	3316	2	11	12
A-D	-36.7192	-80.7908	-114.644	-232.154	40	9	5	4259	6	5	2
B-C	-54.7004	-72.0181	-130.151	-256.8695	38	5	6	4410	6	5	2

Interface residues

• A-B: ALA461A, ALA483A, ALA484A, ALA504A, ALA504B, ARG477A, ARG477B, ASN485A, ASN496A, ASP478A, ASP511B, ASP514B, ASP515B, GLN487A, GLU462A, GLU491A, GLU508B, GLY506A, GLY506B, GLY509B, GLY516B, GLY520A, GLY520B, ILE481A, ILE489A, ILE512B, ILE519B, LEU479A, LEU486A, LEU503A, LEU503B, LYS445B, LYS488A, LYS502A, LYS502B, LYS517B, PHE501A, PHE521A, PHE521B, PRO513A, PRO513B, SER505A, SER510B, THR500A, VAL480A, VAL482A, VAL499A, VAL507A, VAL507B
• A-D: ALA471A, ARG1004D, ARG451A, ARG458A, ASN442A, ASN448A, ASP449A, ASP459A, GLN1006D, GLN466A, GLU453A, GLU467A, GLY1003D, GLY463A, GLY472A, ILE434A, ILE450A, ILE469A, LEU436A, LEU438A, LEU440A, LEU447A, LEU468A, LEU473A, LEU486A, LEU524A, PHE1005D, PHE452A, PHE454A, PRO433A, PRO456A, SER465A, SER470A, THR455A, THR460A, VAL1007D, VAL437A, VAL464A, VAL474A, VAL490A
• B-C: ALA471B, ARG1004C, ARG439B, ARG451B, ARG458B, ASN442B, ASN448B, ASP449B, ASP459B, GLN1006C, GLN466B, GLU446B, GLU453B, GLU467B, GLY1003C, GLY463B, GLY472B, ILE434B, ILE450B, ILE469B, LEU436B, LEU438B, LEU440B, LEU447B, LEU468B, LEU473B, LEU486B, PHE1005C, PHE452B, PHE454B, SER465B, SER470B, THR1008C, THR455B, THR460B, VAL1007C, VAL437B, VAL464B