3APV

crystal structure of the a variant of human alpha1-acid glycoprotein and amitriptyline complex

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 71
  • Norm. En. per Res.: -1.7832
• 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	-19.1742	3.9556	-111.39	-126.6085	71	11	4	4915	0	25	22

Interface residues

• A-B: ARG63A, ARG63B, ARG68A, ARG68B, ARG90A, ARG90B, ARG95A, ARG95B, ASN54A, ASN54B, ASN75A, ASN75B, ASN80A, ASN80B, CYS72A, CYS72B, GLN171A, GLN171B, GLN66A, GLN66B, GLN69A, GLN71A, GLN71B, GLU175B, GLU36A, GLU43A, GLU43B, GLU57A, GLU57B, GLU64A, GLU64B, GLU92A, GLU92B, GLU96A, GLU96B, GLY93A, GLY93B, GLY94A, GLY94B, HIS172A, HIS172B, HIS97A, HIS97B, LEU168A, LEU168B, LEU62A, LEU62B, LEU79A, LYS39A, PHE61A, PHE61B, PHE73A, PHE73B, SER40A, SER40B, SER76A, SER76B, SER77A, SER77B, THR56A, THR56B, THR59A, THR59B, TYR65A, TYR65B, TYR74A, TYR74B, TYR78A, TYR78B, TYR91A, TYR91B