3DDV

the crystal structure of the transcriptional regulator (gntr family) from enterococcus faecalis v583

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 72
  • Norm. En. per Res.: -6.2596
• 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	-103.0802	-78.9925	-249.997	-432.0697	76	15	15	10851	4	20	16
A-C	-8.1794	28.6694	-28.5636	-8.0736	35	1	0	1413	0	9	6
A-D	-5.0469	14.3239	-81.7333	-72.4563	50	9	0	3550	0	18	16
B-C	-13.5515	12.5191	-102.519	-103.5514	59	2	0	4387	0	20	18
C-D	-110.4558	-67.8572	-272.38	-450.693	72	13	17	10056	2	19	12

Interface residues

• A-B: ALA111A, ALA111B, ALA135B, ALA93A, ALA93B, ALA96A, ALA96B, ARG108A, ARG108B, ARG114A, ARG114B, ARG116A, ARG116B, ARG138A, ARG138B, ASN88A, ASN88B, ASP110A, ASP110B, GLN117A, GLN117B, GLN89A, GLN89B, GLN95A, GLN95B, GLU140A, GLU140B, GLU144A, GLU144B, GLY109A, GLY109B, GLY136A, GLY136B, GLY85B, HIS86A, HIS86B, ILE112A, ILE112B, ILE84B, ILE91A, ILE91B, LEU113A, LEU113B, LEU143A, LEU143B, LYS107A, LYS107B, LYS145A, LYS145B, LYS25A, LYS25B, PHE139A, PHE139B, PHE141A, PHE141B, SER119B, SER137A, SER137B, SER87A, SER87B, SER92A, SER92B, THR90A, THR90B, TYR120A, TYR120B, TYR134A, TYR134B, TYR142A, TYR142B, VAL115A, VAL115B, VAL118A, VAL118B, VAL94A, VAL94B
• A-C: ARG116A, ASN123A, ASN123C, ASN88A, ASN88C, GLN27A, GLN27C, GLN89A, GLN89C, GLU122A, GLU122C, GLU24A, GLU24C, GLY124A, GLY124C, GLY85A, GLY85C, HIS86A, HIS86C, LEU125A, LEU125C, LYS25A, LYS25C, PHE121A, PHE121C, PRO126A, PRO126C, SER87A, SER87C, THR90A, THR90C, TYR120A, TYR120C, VAL118A, VAL118C
• A-D: ALA16A, ALA43D, ARG138D, ARG36A, ARG39D, ARG41D, ARG9D, ASN123A, ASN70D, ASP32A, ASP44D, ASP45D, CYS49D, GLN27A, GLN89D, GLU140D, GLU144D, GLU22A, GLU24A, GLU31A, GLU51D, GLY29A, ILE40D, ILE46D, ILE48D, LEU125A, LEU143D, LEU26A, LEU28A, LYS17A, LYS25A, LYS74D, MET23A, PHE139D, PHE141D, PHE42D, PRO126A, PRO18A, PRO30A, SER19A, SER20A, SER21A, SER7D, SER8D, THR132D, THR69D, TYR134D, TYR142D, TYR57A, TYR73D
• B-C: ALA16C, ALA43B, ARG138B, ARG36C, ARG39B, ARG41B, ASN123C, ASN70B, ASP32C, ASP44B, ASP45B, CYS49B, GLN27C, GLN89B, GLU122C, GLU140B, GLU144B, GLU22C, GLU24C, GLU31C, GLU51B, GLY124C, GLY29C, HIS86C, ILE46B, ILE48B, LEU125C, LEU143B, LEU26C, LEU28C, LYS145B, LYS17C, LYS25C, LYS74B, MET23C, PHE121C, PHE139B, PHE141B, PHE42B, PRO126C, PRO18C, PRO30C, PRO47B, SER19C, SER20C, SER21C, SER33C, SER58C, SER71B, SER7B, SER8B, THR132B, TYR120C, TYR134B, TYR142B, TYR57C, TYR73B, VAL15C, VAL60C
• C-D: ALA111C, ALA111D, ALA135D, ALA93C, ALA93D, ALA96C, ALA96D, ARG108C, ARG108D, ARG114C, ARG114D, ARG116C, ARG116D, ARG138C, ARG138D, ASN88C, ASN88D, ASP110C, ASP110D, GLN117C, GLN117D, GLN89C, GLN89D, GLN95C, GLN95D, GLU140C, GLU140D, GLU144C, GLU144D, GLY109C, GLY109D, GLY136C, GLY136D, GLY85D, HIS86D, ILE112C, ILE112D, ILE84D, ILE91C, ILE91D, LEU113C, LEU113D, LEU143C, LEU143D, LYS107C, LYS107D, LYS145C, LYS25C, LYS25D, PHE139C, PHE139D, PHE141C, PHE141D, SER119D, SER137C, SER137D, SER87D, SER92C, SER92D, THR90C, THR90D, TYR120D, TYR134C, TYR134D, TYR142C, TYR142D, TYR73D, VAL115C, VAL115D, VAL118D, VAL94C, VAL94D