3DSL

the three-dimensional structure of bothropasin, the main hemorrhagic factor from bothrops jararaca venom.

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 115
  • Norm. En. per Res.: -2.6123
• 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	-42.3003	-34.1283	-223.984	-300.4126	115	16	1	8920	1	28	19

Interface residues

• A-B: ALA114A, ALA114B, ALA127A, ALA328A, ALA328B, ALA82A, ALA82B, ARG124A, ARG124B, ARG369A, ARG369B, ASN150A, ASN150B, ASN345A, ASN345B, ASN375A, ASN375B, ASN380A, ASN380B, ASN381A, ASN381B, ASN389A, ASN389B, ASN79A, ASN79B, ASP329A, ASP329B, ASP374A, ASP374B, ASP390A, ASP390B, ASP391A, ASP391B, ASP75A, ASP75B, CYS383A, CYS383B, GLN188A, GLN188B, GLN379A, GLN379B, GLU146A, GLU146B, GLU392A, GLU392B, GLY112A, GLY112B, GLY117A, GLY327A, GLY327B, GLY378A, GLY378B, HIS121A, HIS121B, HIS149A, HIS149B, HIS154A, HIS154B, HIS155A, HIS155B, ILE116A, ILE116B, ILE128B, ILE153A, LEU325A, LEU325B, LEU78A, LEU78B, LYS123A, LYS123B, LYS357A, LYS384A, LYS384B, LYS394A, LYS394B, MET385A, MET385B, PHE326A, PHE326B, PHE386A, PHE386B, PRO377A, PRO377B, SER118A, SER118B, SER376A, SER376B, SER388A, SER388B, SER80B, THR110B, THR157A, THR157B, TYR113A, TYR113B, TYR115A, TYR115B, TYR323A, TYR323B, TYR331B, TYR346A, TYR346B, TYR347A, TYR347B, TYR371A, TYR387A, TYR387B, TYR76A, TYR76B, VAL126A, VAL126B, VAL330A, VAL330B, VAL74A, VAL74B