3AFK

crystal structure of agrocybe aegerita lectin aal complexed with thomsen-friedenreich antigen

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 116
  • Norm. En. per Res.: -5.1041
• 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	-155.1119	-15.8692	-421.096	-592.0771	116	24	8	14881	7	16	38

Interface residues

• A-B: ALA100A, ALA100B, ALA151A, ALA151B, ALA158A, ALA158B, ALA17A, ALA17B, ASN116A, ASN116B, ASN4A, ASN4B, ASN7A, ASN7B, ASP106A, ASP106B, ASP24A, ASP24B, ASP97A, GLN112A, GLN112B, GLN122A, GLN122B, GLN1A, GLN1B, GLU117A, GLU117B, GLU150A, GLU150B, GLU160A, GLU160B, GLY108A, GLY108B, GLY156A, GLY156B, GLY23A, GLY23B, GLY2A, GLY2B, GLY95A, HIS107A, HIS107B, HIS161A, HIS161B, HIS162A, HIS162B, HIS163A, HIS163B, HIS164A, HIS164B, HIS165A, HIS165B, HIS166A, ILE115A, ILE115B, ILE25A, ILE25B, ILE5A, ILE5B, ILE96A, ILE96B, LEU157A, LEU157B, LEU159A, LEU159B, LYS110A, LYS110B, LYS118A, LYS118B, LYS99A, LYS99B, MET0A, MET0B, MET101A, MET101B, PHE105A, PHE105B, PHE28A, PHE28B, PHE29A, PHE29B, SER31B, THR103A, THR103B, THR119A, THR119B, THR153A, THR153B, THR155A, THR155B, THR21B, THR22A, THR22B, THR27A, THR27B, TYR154A, TYR154B, TYR6A, TYR6B, VAL102A, VAL102B, VAL104A, VAL104B, VAL113A, VAL113B, VAL114A, VAL114B, VAL148A, VAL148B, VAL149B, VAL152A, VAL152B, VAL26A, VAL26B, VAL3A, VAL3B