1UEF

crystal structure of dok1 ptb domain complex

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 50
  • Norm. En. per Res.: -4.5177
• 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	-17.4111	0.0	-122.317	-139.7281	53	17	3	5471	0	3	4
A-C	-45.6994	-12.3379	-167.847	-225.8843	50	11	3	5969	0	6	5
B-C	0.0	0.0	-0.5002	-0.5002	6	0	0	68	0	0	0
B-D	-40.7593	-4.1674	-158.355	-203.2817	47	14	3	5356	0	5	5

Interface residues

• A-B: ALA100A, ALA101A, ALA107A, ALA33A, ALA33B, ALA43B, ARG30B, ARG76A, CYS77A, GLN103A, GLN104A, GLN105A, GLN108A, GLN44B, GLN46B, GLN7B, GLN90B, GLU32A, GLU32B, GLU34A, GLU49B, GLY25B, GLY42B, GLY5A, GLY5B, ILE102A, ILE28B, ILE47B, LEU36A, LEU39B, LEU41B, LEU48B, LEU58A, LYS106A, LYS35A, MET4A, PHE53A, PHE8B, PRO55A, PRO78A, SER26B, SER45B, SER6B, THR11B, THR37A, THR40B, THR57A, TRP54A, TRP9B, TYR27B, TYR56A, VAL10B, VAL31B
• A-C: ALA101A, ALA107A, ALA33A, ALA73A, ARG60A, ARG61A, ARG64A, ARG76A, ASN6C, ASN92A, ASP65A, GLN103A, GLN104A, GLN105A, GLN108A, GLU34A, GLU5C, GLU72A, GLU99A, GLY10C, GLY63A, GLY74A, GLY82A, ILE102A, ILE4C, LEU58A, LEU59A, LEU8C, LYS106A, LYS35A, LYS66A, LYS7C, MET11C, MET68A, PHE69A, PHE71A, PHE84A, PHE95A, PRO55A, SER70A, THR15A, THR2C, THR57A, THR83A, THR85A, TRP3C, TYR56A, TYR62A, VAL67A, VAL98A
• B-C: GLN46B, GLY10C, LEU41B, LEU8C, MET11C, TRP9B
• B-D: ALA101B, ALA107B, ALA33B, ALA73B, ARG60B, ARG61B, ARG64B, ARG76B, ASN6D, ASN92B, ASP65B, GLN103B, GLN104B, GLN105B, GLU34B, GLU5D, GLU72B, GLU99B, GLY63B, GLY82B, GLY91B, ILE102B, ILE4D, LEU58B, LEU59B, LEU8D, LYS106B, LYS66B, LYS7D, MET68B, PHE69B, PHE71B, PHE84B, PHE95B, PRO55B, SER70B, THR15B, THR2D, THR57B, THR83B, THR85B, TRP3D, TRP54B, TYR56B, TYR62B, VAL67B, VAL98B