3HZW

crystal structure of bothropstoxin-i chemically modified by p- bromophenacyl bromide (bpb)

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 61
  • Norm. En. per Res.: -1.3804
• 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	-2.3703	6.7314	-88.5659	-84.2048	61	10	9	4855	0	3	43

Interface residues

• A-B: ALA19A, ALA19B, ALA24A, ALA24B, ARG118A, ARG118B, ARG72A, ARG72B, ASN17A, ASN17B, ASP67B, CYS126B, GLY23A, GLY23B, GLY30A, GLY30B, GLY33A, GLY33B, GLY6A, GLY6B, HIS120A, HIS120B, LEU10B, LEU121A, LEU121B, LEU2A, LEU2B, LEU32A, LEU32B, LEU5A, LEU5B, LYS115B, LYS122A, LYS122B, LYS16B, LYS20A, LYS20B, LYS69A, LYS69B, LYS70A, LYS70B, LYS7A, LYS7B, PHE3A, PHE3B, PRO123A, PRO123B, PRO18A, PRO18B, PRO68B, SER1A, SER1B, SER21A, SER21B, TYR119A, TYR119B, TYR22A, TYR25A, TYR25B, VAL31A, VAL31B