2KA9

solution structure of psd-95 pdz12 complexed with cypin peptide

• Total interactions analyzed: 3
• Total true interactions: 2
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 39
  • Norm. En. per Res.: -3.2788
• 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	-42.6622	0.0	-81.7259	-124.3881	44	13	2	3248	0	0	0
A-C	-41.7634	0.0	-86.1097	-127.8731	39	11	1	3569	0	0	0

Interface residues

• A-B: ALA20A, ALA44A, ALA45A, ALA73A, ALA76A, ALA80A, ARG10A, ASN25A, GLN1B, GLU75A, GLY14A, GLY16A, GLY21A, GLY29A, GLY43A, HIS27A, HIS70A, ILE19A, ILE28A, ILE34A, ILE36A, ILE39A, ILE40A, LEU15A, LEU77A, LEU8A, LYS38A, LYS78A, PHE17A, PHE35A, PHE5B, PRO26A, PRO4B, SER13A, SER18A, SER6B, SER7B, SER8B, THR37A, VAL2B, VAL3B, VAL74A, VAL84A, VAL9B
• A-C: ALA115A, ALA139A, ALA140A, ALA168A, ALA170A, ASN120A, GLU166A, GLY106A, GLY109A, GLY111A, GLY116A, GLY119A, HIS122A, HIS165A, ILE114A, ILE129A, ILE134A, ILE135A, LEU103A, LEU110A, LEU172A, LYS105A, LYS108A, LYS133A, LYS173A, PHE112A, PHE5C, PRO4C, SER113A, SER6C, SER7C, SER8C, THR132A, TYR130A, VAL131A, VAL169A, VAL2C, VAL3C, VAL9C