2NX4

the crystal structure of athe putative tetr-family transcriptional regulator rha06780 from rhodococcus sp. rha1.

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 173
  • Norm. En. per Res.: -3.6936
• 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	-21.75	-13.6239	-603.611	-638.9848	173	16	8	22713	3	24	36
A-C	0.0	-9.3687	-16.0282	-25.3969	17	0	0	722	3	9	10
A-D	-26.9393	-109.8212	-152.567	-289.3276	91	10	4	6916	7	42	38
B-D	-8.9438	-30.3081	-21.8062	-61.0581	17	0	0	842	8	10	11
C-D	-17.3222	-6.9465	-607.778	-632.0467	173	17	7	22928	6	25	37

Interface residues

• A-B: ALA103A, ALA103B, ALA106A, ALA106B, ALA107A, ALA107B, ALA113A, ALA113B, ALA120A, ALA120B, ALA121A, ALA121B, ALA191A, ALA191B, ALA192A, ALA192B, ALA23A, ALA23B, ALA24A, ALA24B, ALA29A, ALA29B, ALA30A, ARG104A, ARG104B, ARG112A, ARG112B, ARG124A, ARG124B, ARG125A, ARG125B, ARG131A, ARG131B, ARG181A, ARG181B, ARG20A, ARG20B, ARG25A, ARG25B, ASN123A, ASN123B, ASN161A, ASN161B, ASP116A, ASP116B, ASP128A, ASP128B, ASP149B, ASP151A, ASP151B, ASP54A, ASP54B, GLN158A, GLN158B, GLN167A, GLN167B, GLN182A, GLN182B, GLN188A, GLN188B, GLU117A, GLU117B, GLU157A, GLU157B, GLU176A, GLU176B, GLU180A, GLU180B, GLU184A, GLU184B, GLU187A, GLU187B, GLU28A, GLU28B, GLY165A, GLY165B, GLY170A, GLY170B, GLY175A, GLY175B, GLY26A, GLY26B, ILE105A, ILE105B, ILE150A, ILE150B, ILE154A, ILE154B, ILE168A, ILE168B, ILE22A, ILE22B, ILE27A, ILE27B, LEU100A, LEU100B, LEU101A, LEU101B, LEU109A, LEU109B, LEU159A, LEU159B, LEU160A, LEU160B, LEU169A, LEU169B, LEU172A, LEU172B, LEU183A, LEU183B, LEU186A, LEU186B, LEU193A, LEU193B, LEU21A, LEU21B, LEU57A, LEU57B, LYS53A, LYS53B, MET114A, MET114B, MET119A, MET119B, MET127A, MET127B, MET162A, MET162B, MET163A, MET163B, MET164A, MET164B, MET166A, MET166B, MET185A, MET185B, PHE189A, PHE189B, PRO111A, PRO111B, PRO174A, PRO174B, PRO94A, PRO94B, SER108A, SER108B, SER178A, SER178B, THR153A, THR153B, THR173A, THR173B, THR177A, THR177B, TRP110A, TRP110B, TRP130A, TRP130B, TRP19A, TYR115A, TYR115B, TYR61A, TYR61B, VAL152A, VAL152B, VAL155A, VAL155B, VAL156A, VAL156B, VAL171A, VAL171B, VAL190A, VAL190B
• A-C: ALA120C, ALA121C, ARG124C, ARG181A, ARG90A, ASN96A, ASP116C, GLU117C, GLU180A, GLU97A, GLU98A, ILE95A, LEU183A, MET114C, SER178A, SER179A, TYR115C
• A-D: ALA16A, ALA16D, ALA17A, ALA17D, ALA18A, ALA18D, ALA23A, ALA23D, ALA24A, ALA24D, ALA30A, ALA30D, ALA39A, ALA39D, ALA67A, ALA67D, ARG104A, ARG104D, ARG12D, ARG20A, ARG20D, ARG25A, ARG25D, ARG33A, ARG70A, ARG70D, ARG71A, ARG71D, ASN96A, ASN96D, ASP34A, ASP34D, GLN99A, GLN99D, GLU102A, GLU102D, GLU176A, GLU176D, GLU180A, GLU180D, GLU38A, GLU38D, GLU97A, GLU97D, GLU98A, GLU98D, GLY170D, GLY175A, GLY175D, GLY26A, GLY26D, GLY40A, GLY40D, HIS63A, HIS63D, ILE14A, ILE14D, ILE22A, ILE22D, ILE35A, ILE35D, LEU100A, LEU100D, LEU101A, LEU101D, LEU172A, LEU172D, LEU21A, LEU21D, PRO174A, PRO174D, SER13A, SER13D, SER178A, SER178D, SER179A, SER179D, THR15A, THR15D, THR173A, THR173D, THR177A, THR177D, THR37A, THR37D, TRP19A, TRP19D, TYR41A, TYR41D, VAL171A, VAL171D
• B-D: ALA120B, ALA121B, ARG124B, ARG181D, ARG90D, ASN96D, ASP116B, GLU117B, GLU180D, GLU97D, GLU98D, ILE95D, LEU183D, MET114B, SER178D, SER179D, TYR115B
• C-D: ALA103C, ALA103D, ALA106C, ALA106D, ALA107C, ALA107D, ALA113C, ALA113D, ALA120C, ALA120D, ALA121C, ALA121D, ALA191C, ALA191D, ALA192C, ALA192D, ALA23C, ALA23D, ALA24C, ALA24D, ALA29C, ALA29D, ALA30C, ARG104C, ARG104D, ARG112C, ARG112D, ARG124C, ARG124D, ARG125C, ARG125D, ARG131C, ARG131D, ARG181C, ARG181D, ARG20C, ARG20D, ARG25C, ARG25D, ASN123C, ASN123D, ASN161C, ASN161D, ASP116C, ASP116D, ASP128C, ASP128D, ASP149C, ASP151C, ASP151D, ASP54C, ASP54D, GLN158C, GLN158D, GLN167C, GLN167D, GLN182C, GLN182D, GLN188C, GLN188D, GLU117C, GLU117D, GLU157C, GLU157D, GLU176C, GLU176D, GLU180C, GLU180D, GLU184C, GLU184D, GLU187C, GLU187D, GLU28C, GLU28D, GLY165C, GLY165D, GLY170C, GLY170D, GLY175C, GLY175D, GLY26C, GLY26D, ILE105C, ILE105D, ILE150C, ILE150D, ILE154C, ILE154D, ILE168C, ILE168D, ILE22C, ILE22D, ILE27C, ILE27D, LEU100C, LEU100D, LEU101C, LEU101D, LEU109C, LEU109D, LEU159C, LEU159D, LEU160C, LEU160D, LEU169C, LEU169D, LEU172C, LEU172D, LEU183C, LEU183D, LEU186C, LEU186D, LEU193C, LEU193D, LEU21C, LEU21D, LEU57C, LEU57D, LYS53C, LYS53D, MET114C, MET114D, MET119C, MET119D, MET127C, MET127D, MET162C, MET162D, MET163C, MET163D, MET164C, MET164D, MET166C, MET166D, MET185C, MET185D, PHE189C, PHE189D, PRO111C, PRO111D, PRO174C, PRO174D, PRO94C, PRO94D, SER108C, SER108D, SER178C, SER178D, THR126D, THR153C, THR153D, THR173C, THR173D, THR177C, THR177D, TRP110C, TRP110D, TRP130C, TRP130D, TYR115C, TYR115D, TYR61C, TYR61D, VAL152C, VAL152D, VAL155C, VAL155D, VAL156C, VAL156D, VAL171C, VAL171D, VAL190C, VAL190D