2NLC

human beta-defensin-1 (mutant ser8ala)

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 35
  • Norm. En. per Res.: -2.578
• 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	-9.6805	0.0	-80.5491	-90.2296	35	2	2	3090	0	0	2
B-C	0.0	0.0	-0.2862	-0.2862	4	0	0	46	0	1	0
C-D	-6.748	0.0	-79.2589	-86.0069	36	2	2	3023	0	0	3

Interface residues

• A-B: ALA16B, ALA32B, ALA8A, ARG29B, CYS12A, CYS12B, CYS17A, CYS17B, CYS27B, CYS35A, CYS35B, CYS5A, GLN11A, GLN11B, GLY10A, GLY9A, HIS2A, HIS2B, ILE19A, ILE19B, LEU13A, LEU13B, LYS31B, LYS33B, LYS36A, PHE20A, PRO18A, PRO18B, SER15B, SER7A, THR21A, TYR14B, TYR28B, TYR3A, VAL6A
• B-C: ASN4B, ASN4C, GLN24B, TYR3C
• C-D: ALA16D, ALA32D, ALA8C, ARG29D, CYS12C, CYS12D, CYS17D, CYS27D, CYS34C, CYS35C, CYS35D, CYS5C, GLN11C, GLN11D, GLN24C, GLY10C, GLY9C, HIS2C, HIS2D, ILE19C, ILE19D, LEU13C, LEU13D, LYS31D, LYS36C, PHE20C, PRO18C, PRO18D, SER15D, SER7C, THR21C, THR21D, TYR14D, TYR28D, TYR3C, VAL6C