2VFI

crystal structure of the plasmodium falciparum triosephosphate isomerase in the loop closed state with 3- phosphoglycerate bound at the active site and interface

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 141
  • Norm. En. per Res.: -4.7981
• 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	-97.158	-54.8816	-524.498	-676.5376	141	16	18	19325	4	52	43

Interface residues

• A-B: ALA80A, ALA80B, ALA83A, ALA83B, ARG98A, ARG98B, ARG99A, ARG99B, ASN10A, ASN10B, ASN14A, ASN14B, ASN233A, ASN233B, ASN65A, ASN65B, ASN71A, ASN71B, ASN87A, ASN87B, ASP108A, ASP108B, ASP49A, ASP49B, ASP85A, ASP85B, CYS126A, CYS126B, CYS13A, CYS13B, GLN64A, GLN64B, GLU104A, GLU104B, GLU165A, GLU165B, GLU18A, GLU18B, GLU77A, GLU77B, GLU81A, GLU81B, GLU97A, GLU97B, GLY15A, GLY15B, GLY171A, GLY171B, GLY232A, GLY232B, GLY70A, GLY70B, GLY72A, GLY72B, GLY76A, GLY76B, GLY94A, GLY94B, HIS103A, HIS103B, HIS47A, HIS47B, HIS50A, HIS50B, HIS95A, HIS95B, ILE170A, ILE170B, ILE20A, ILE20B, ILE63A, ILE63B, ILE82A, ILE82B, ILE88A, ILE88B, ILE92A, ILE92B, ILE93A, ILE93B, LEU17A, LEU17B, LEU230A, LEU230B, LEU236A, LEU236B, LEU86A, LEU86B, LYS100A, LYS100B, LYS112A, LYS112B, LYS12A, LYS12B, LYS53A, LYS53B, LYS68A, LYS68B, LYS84B, PHE102A, PHE102B, PHE42A, PHE42B, PHE69A, PHE69B, PHE96A, PHE96B, PRO43A, PRO43B, SER19A, SER19B, SER45A, SER45B, SER67A, SER67B, SER73A, SER73B, SER79A, SER79B, THR105A, THR105B, THR16A, THR16B, THR75A, THR75B, TRP11A, TRP11B, TYR101A, TYR101B, TYR48A, TYR48B, TYR74A, TYR74B, VAL44A, VAL44B, VAL46A, VAL46B, VAL66A, VAL66B, VAL78A, VAL78B