3DVP

pak1 peptide bound lc8

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 79
  • Norm. En. per Res.: -6.8723
• Hub Node: A(3)

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	-173.6804	6.9226	-376.153	-542.9108	79	29	10	12053	0	8	16
A-C	-74.8178	-20.1032	-177.401	-272.322	42	17	3	5831	2	7	7
A-D	0.0	-2.0861	-23.0648	-25.1509	29	4	1	1164	0	6	6
B-C	0.0	-4.7312	-19.0738	-23.805	28	1	1	1045	0	6	6
B-D	-75.9983	-10.3292	-170.917	-257.2444	41	11	3	5669	0	7	7

Interface residues

• A-B: ALA39A, ALA39B, ALA40A, ALA40B, ALA82A, ALA82B, ARG60A, ARG60B, ASN61A, ASN61B, ASP37A, ASP37B, ASP47A, ASP47B, CYS56A, CYS56B, GLN80A, GLU35A, GLU35B, GLU69A, GLU69B, GLY59A, GLY59B, GLY63A, GLY63B, GLY89A, GLY89B, HIS55A, HIS55B, HIS68A, HIS68B, ILE34A, ILE34B, ILE38A, ILE38B, ILE42A, ILE42B, ILE57A, ILE57B, ILE83A, ILE83B, LEU84A, LEU84B, LEU85A, LEU85B, LYS43A, LYS43B, LYS44A, LYS44B, LYS87A, LYS87B, PHE62A, PHE62B, PHE86A, PHE86B, PRO36A, PRO36B, PRO52A, PRO52B, SER64A, SER64B, SER88A, SER88B, THR53A, THR53B, THR67A, THR67B, TRP54A, TRP54B, TYR41A, TYR41B, TYR65A, TYR65B, VAL58A, VAL58B, VAL66A, VAL66B, VAL81A, VAL81B
• A-C: ALA11A, ALA218C, ALA82A, ARG215C, ARG60A, ARG71A, ASN10A, ASN61A, ASP12A, ASP216C, GLU69A, GLY59A, GLY63A, GLY89A, HIS68A, HIS72A, ILE57A, ILE74A, ILE83A, LEU84A, LEU85A, LYS87A, LYS9A, MET13A, PHE62A, PHE73A, PHE76A, PHE86A, PRO213C, PRO221C, SER220C, SER64A, SER88A, THR214C, THR219C, THR67A, THR70A, TYR65A, TYR75A, TYR77A, VAL217C, VAL66A
• A-D: ALA218D, ALA39A, ALA40A, ARG215D, ARG60A, ASN61A, ASP216D, ASP37A, ASP47A, CYS56A, GLU35A, GLY59A, GLY89A, HIS55A, ILE34A, ILE57A, LYS43A, LYS44A, PHE62A, PRO221D, PRO36A, PRO52A, SER220D, THR214D, THR219D, THR53A, TRP54A, VAL217D, VAL58A
• B-C: ALA218C, ALA39B, ALA40B, ARG215C, ARG60B, ASN61B, ASP216C, ASP37B, ASP47B, CYS56B, GLU35B, GLY59B, GLY89B, HIS55B, ILE34B, ILE57B, LYS43B, LYS44B, PRO221C, PRO36B, PRO52B, SER220C, THR214C, THR219C, THR53B, TRP54B, VAL217C, VAL58B
• B-D: ALA11B, ALA218D, ALA82B, ARG215D, ARG60B, ARG71B, ASN10B, ASN61B, ASP12B, ASP216D, GLU69B, GLY59B, GLY63B, GLY89B, HIS68B, HIS72B, ILE57B, ILE74B, ILE83B, LEU84B, LEU85B, LYS87B, LYS9B, PHE62B, PHE73B, PHE76B, PHE86B, PRO213D, PRO221D, SER220D, SER64B, SER88B, THR214D, THR219D, THR67B, THR70B, TYR65B, TYR75B, TYR77B, VAL217D, VAL66B