3QOC

crystal structure of n-terminal domain (creatinase/prolidase like domain) of putative metallopeptidase from corynebacterium diphtheriae

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 37
  • Norm. En. per Res.: -3.8439
• Hub Node: A(3)

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	-39.6701	0.0	-102.555	-142.2251	37	5	5	3866	0	1	7
A-C	-5.3513	-2.5405	-61.6511	-69.5428	32	4	0	2593	0	8	7
A-D	-26.7647	10.0657	-80.7594	-97.4584	45	2	0	3453	0	17	15
B-C	0.0	10.1115	-66.304	-56.1925	43	2	0	2876	0	17	15
B-D	-15.4469	-1.7034	-51.9258	-69.0761	31	1	0	2369	0	8	7
C-D	0.0	0.0	-4.4983	-4.4983	16	0	0	239	0	7	10

Interface residues

• A-B: ALA103A, ALA103B, ARG115A, ASP104A, ASP104B, CYS111A, CYS111B, GLN110A, GLN110B, GLU102A, GLU102B, GLU112A, GLU112B, GLY129A, ILE125A, ILE125B, LEU106A, LEU106B, LEU114A, LEU114B, LEU124A, PHE101A, PHE101B, PRO126A, PRO126B, SER107A, SER107B, SER109A, SER109B, THR128A, THR128B, TYR105A, TYR105B, VAL108A, VAL108B, VAL127A, VAL127B
• A-C: ALA71C, ALA82A, ALA82C, ARG59C, ARG65A, ARG65C, ARG83A, ASN47A, ASN84A, ASP63A, ASP63C, GLN69C, GLU72C, GLU78C, GLY64A, GLY64C, ILE60C, ILE67A, ILE67C, ILE70C, ILE77C, LEU80C, PRO4C, PRO75C, SER46A, SER61C, SER79C, THR62C, THR68A, THR68C, TYR66A, TYR66C
• A-D: ALA118D, ALA130A, ALA16A, ARG115D, ARG13A, ARG38A, ARG9A, ASN84D, ASP104A, ASP121D, CYS111D, GLN20A, GLN73A, GLU112D, GLU113D, GLU123D, GLY119D, GLY129A, GLY42A, GLY45A, HIS33A, HIS36A, ILE131A, ILE37A, LEU114D, LEU124D, LEU17A, LEU34A, LEU40A, LEU90D, LYS116D, LYS24A, PHE43A, PRO87D, SER109D, SER117D, SER120D, SER46A, SER91D, THR35A, THR44A, TYR105A, TYR39A, VAL108D, VAL122D
• B-C: ALA118C, ALA16B, ARG115C, ARG13B, ARG38B, ARG9B, ASN84C, ASP121C, CYS111C, GLN20B, GLN69B, GLN73B, GLU112C, GLU113C, GLU123C, GLY119C, GLY42B, GLY45B, HIS33B, HIS36B, ILE37B, ILE93C, LEU114C, LEU124C, LEU17B, LEU34B, LEU40B, LEU90C, LYS116C, LYS24B, PHE10B, PHE43B, PRO87C, SER117C, SER120C, SER46B, SER91C, THR35B, THR44B, TYR105B, TYR39B, TYR66B, VAL122C
• B-D: ALA71D, ALA82B, ALA82D, ARG59D, ARG65B, ARG65D, ARG83B, ASN47B, ASN84B, ASP63B, ASP63D, GLN69D, GLU72D, GLU78D, GLY45B, GLY64B, GLY64D, ILE60D, ILE67B, ILE67D, ILE70D, ILE77D, LEU34B, LEU80D, SER46B, SER61D, SER79D, THR62D, THR68D, TYR66B, TYR66D
• C-D: ARG59C, ARG59D, ASN94C, ASN94D, ASP55C, ASP92C, ASP92D, ILE93C, ILE93D, LYS97C, LYS97D, PRO96C, PRO96D, SER57C, SER57D, SER91C