2C0A

mechanism of the class i kdpg aldolase

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 72
  • Norm. En. per Res.: -1.7745
• Hub Node: A(2)

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	-10.8931	28.4497	-148.451	-130.8945	74	1	4	6466	0	4	7
A-C	0.0	27.2884	-141.188	-113.8996	73	5	4	6193	0	4	7
B-C	-12.5484	26.2875	-141.503	-127.7639	72	5	4	6346	0	4	7

Interface residues

• A-B: ALA137A, ALA139A, ALA145B, ALA148B, ALA150B, ARG49A, ASN140A, ASN140B, ASN76A, ASP126B, GLN147B, GLN155B, GLN79A, GLU120A, GLU120B, GLU138A, GLU98A, GLU98B, GLY114A, GLY124B, GLY141A, GLY141B, GLY142B, GLY151B, GLY162A, GLY163A, GLY72A, GLY95A, ILE115A, ILE149B, ILE92A, LEU100A, LEU101A, LEU111A, LEU121B, LEU123A, LEU123B, LEU146B, LEU48A, LEU75A, LEU96A, LYS133A, LYS144B, MET122B, MET125B, PHE134B, PHE135A, PHE153B, PRO113A, PRO136A, PRO152B, PRO77A, PRO94A, PRO99A, SER116A, SER116B, SER119A, SER119B, SER154B, SER93A, THR117A, THR117B, THR161A, THR47A, THR50A, THR73A, THR97A, TYR127B, VAL118B, VAL143B, VAL156B, VAL20A, VAL22A, VAL74A
• A-C: ALA137C, ALA139A, ALA139C, ALA145A, ALA148A, ALA150A, ARG49C, ASN140A, ASN140C, ASN76C, ASP126A, GLN147A, GLN155A, GLN79C, GLU120A, GLU120C, GLU138C, GLU98A, GLU98C, GLY114C, GLY124A, GLY141A, GLY141C, GLY142A, GLY151A, GLY162C, GLY163C, GLY72C, GLY95C, ILE115C, ILE149A, ILE92C, LEU100C, LEU101C, LEU111C, LEU121A, LEU123A, LEU123C, LEU146A, LEU48C, LEU75C, LEU96C, LYS133C, LYS144A, MET122A, MET125A, PHE134A, PHE135C, PHE153A, PRO113C, PRO136C, PRO152A, PRO77C, PRO94C, PRO99C, SER116A, SER116C, SER119A, SER119C, SER154A, SER93C, THR117A, THR117C, THR161C, THR47C, THR73C, THR97C, TYR127A, VAL118A, VAL156A, VAL20C, VAL22C, VAL74C
• B-C: ALA137B, ALA139B, ALA139C, ALA145C, ALA148C, ALA150C, ARG49B, ASN140B, ASN140C, ASN76B, ASP126C, GLN147C, GLN79B, GLU120B, GLU120C, GLU138B, GLU98B, GLU98C, GLY114B, GLY124C, GLY141B, GLY141C, GLY142C, GLY151C, GLY162B, GLY163B, GLY72B, GLY95B, ILE115B, ILE149C, LEU100B, LEU101B, LEU111B, LEU121C, LEU123B, LEU123C, LEU146C, LEU48B, LEU75B, LEU96B, LYS133B, LYS144C, MET122C, MET125C, PHE134C, PHE135B, PHE153C, PRO113B, PRO136B, PRO152C, PRO77B, PRO94B, PRO99B, SER116B, SER116C, SER119B, SER119C, SER154C, SER93B, THR117B, THR117C, THR161B, THR47B, THR73B, THR97B, TYR127C, VAL118C, VAL143C, VAL156C, VAL20B, VAL22B, VAL74B