3MLF

putative transcriptional regulator from staphylococcus aureus.

• Total interactions analyzed: 10
• Total true interactions: 4
• Strongest Interaction:
  • Chains: C-E
  • Int. Res.: 34
  • Norm. En. per Res.: -4.2374
• 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	-28.922	-11.4398	-247.125	-287.4869	104	10	11	11714	4	39	26
A-C	0.0	15.7775	-63.5298	-47.7523	20	0	3	2004	0	6	9
C-D	-11.564	-11.3135	-263.334	-286.2115	102	7	11	11973	5	37	26
C-E	-36.6462	8.5113	-115.938	-144.0729	34	14	1	4423	0	14	16

Interface residues

• A-B: ALA0A, ALA0B, ALA50A, ALA50B, ALA80A, ALA80B, ARG8A, ARG8B, ASN-1A, ASN-1B, ASN-7A, ASN-7B, ASN52A, ASN52B, ASN71A, ASN71B, ASP10A, ASP10B, ASP20A, ASP20B, ASP56B, ASP57B, ASP72A, GLN-3A, GLN-3B, GLN85A, GLU-8A, GLU17A, GLU17B, GLU6A, GLU6B, GLU83A, GLU83B, GLY12A, GLY12B, ILE58B, ILE77A, ILE77B, ILE78A, ILE78B, LEU-6A, LEU13A, LEU13B, LEU18A, LEU18B, LEU21A, LEU21B, LEU43A, LEU43B, LEU79A, LEU79B, LEU7A, LEU7B, LYS23A, LYS23B, LYS2A, LYS2B, LYS46A, LYS46B, LYS54B, LYS73A, LYS73B, LYS74A, LYS74B, LYS75A, LYS75B, LYS82A, LYS82B, LYS84A, LYS84B, PHE-4A, PHE-4B, PHE22A, PHE22B, PHE51A, PHE51B, PHE69A, PHE69B, PHE81A, PHE81B, SER-2A, SER-2B, SER42A, SER42B, SER45A, SER45B, SER49A, SER49B, SER76A, SER76B, THR-9A, THR14A, THR14B, THR70A, THR70B, THR9A, THR9B, TYR-5A, TYR-5B, TYR11A, TYR11B, TYR47A, TYR47B, VAL53B
• A-C: ASN62A, ASN62C, ASN66A, ASN66C, ASN71A, ASN71C, ASP35A, ASP35C, GLU63A, GLU63C, GLU65A, GLU65C, LYS34A, LYS34C, PHE67A, PHE67C, TYR64A, TYR64C, VAL68A, VAL68C
• C-D: ALA0C, ALA0D, ALA50C, ALA50D, ALA80C, ALA80D, ARG8C, ARG8D, ASN-1C, ASN-1D, ASN-7C, ASN-7D, ASN52C, ASN52D, ASN71C, ASN71D, ASP10C, ASP10D, ASP20C, ASP20D, ASP56C, ASP57C, ASP72C, ASP72D, GLN-3C, GLN-3D, GLN85D, GLU17C, GLU17D, GLU6C, GLU6D, GLU83C, GLU83D, GLY12C, GLY12D, ILE58C, ILE77C, ILE77D, ILE78C, ILE78D, LEU-6D, LEU13C, LEU13D, LEU18C, LEU18D, LEU21C, LEU21D, LEU43C, LEU43D, LEU79C, LEU79D, LEU7C, LEU7D, LYS23C, LYS23D, LYS2C, LYS2D, LYS46C, LYS46D, LYS54C, LYS73C, LYS73D, LYS74C, LYS74D, LYS75C, LYS75D, LYS82C, LYS82D, LYS84C, LYS84D, PHE-4C, PHE-4D, PHE22C, PHE22D, PHE51C, PHE51D, PHE69C, PHE81C, PHE81D, SER-2C, SER-2D, SER42C, SER42D, SER45C, SER45D, SER49C, SER49D, SER76C, SER76D, THR14C, THR14D, THR70C, THR70D, THR9C, THR9D, TYR-5C, TYR-5D, TYR11C, TYR11D, TYR47C, TYR47D, VAL53C
• C-E: ASN38C, ASN38E, ASP41C, ASP41E, ASP56C, ASP56E, GLY61C, GLY61E, ILE39C, ILE39E, ILE58E, LEU43C, LEU43E, LEU44C, LEU44E, LEU60C, LEU60E, LYS40C, LYS40E, LYS46C, LYS46E, LYS54C, LYS54E, SER36C, SER36E, SER42C, SER42E, SER45C, SER45E, THR37C, THR37E, TYR55C, TYR55E, VAL24E