3NRG

crystal structure of a tetr family transcriptional regulator (caur_2714) from chloroflexus aurantiacus j-10-fl at 2.56 a resolution

• Total interactions analyzed: 10
• Total true interactions: 5
• Strongest Interaction:
  • Chains: D-E
  • Int. Res.: 133
  • Norm. En. per Res.: -3.6433
• 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-C	0.0	2.6349	-12.8017	-10.1668	31	0	0	1023	0	7	5
A-D	-18.2111	2.5171	-218.88	-234.574	118	8	6	9693	0	37	29
B-C	-99.4829	-14.8177	-358.46	-472.7606	136	12	12	13479	14	63	74
C-D	0.0	0.0	-1.3873	-1.3873	9	0	0	233	0	2	1
D-E	-97.2418	-52.0444	-335.273	-484.5592	133	11	11	13288	14	61	73

Interface residues

• A-C: ALA54C, ALA81A, ALA88A, ARG199A, ARG200A, ARG91A, ASN8C, ASP55C, ASP58C, ASP95A, GLN195A, GLN51C, GLU203A, GLU4C, GLY0C, LEU9C, PHE49C, PHE53C, PHE7C, PRO10C, PRO196A, PRO2C, PRO80A, SER82A, THR3C, THR5C, THR83A, TRP92A, TYR50C, TYR52C, VAL192A
• A-D: ALA135A, ALA179D, ALA183D, ALA197D, ALA42D, ALA45D, ALA73A, ALA81A, ALA88A, ARG106D, ARG14A, ARG14D, ARG16D, ARG187D, ARG199D, ARG200D, ARG41D, ARG76A, ASN104A, ASN104D, ASN181D, ASN8A, ASP147A, ASP19D, ASP23D, ASP85A, GLN139A, GLN143A, GLN195D, GLN27D, GLN51D, GLN65A, GLN70A, GLN70D, GLN77A, GLN99D, GLU11A, GLU11D, GLU12D, GLU142A, GLU184D, GLU188D, GLU40D, GLU4A, GLU69A, GLY132A, GLY144A, GLY189D, GLY190D, GLY43D, GLY47D, GLY67A, HIS103A, HIS103D, ILE18A, ILE18D, ILE191D, ILE44D, ILE68A, LEU107A, LEU107D, LEU140A, LEU17D, LEU185D, LEU186D, LEU193D, LEU194D, LEU22D, LEU66A, LEU75A, LEU90A, LEU93A, LEU9A, LEU9D, LYS13D, LYS46D, LYS71A, PHE100A, PHE102D, PHE137A, PHE178D, PHE6A, PHE74A, PHE74D, PHE7A, PHE87A, PRO105D, PRO10D, PRO182D, PRO196D, PRO2A, PRO79A, PRO79D, PRO80A, SER133A, SER149A, SER15A, SER15D, SER48D, SER82A, THR39D, THR3A, THR5A, THR72A, THR78A, THR83A, THR84A, TRP92A, TYR136A, TYR52D, TYR62A, TYR89A, VAL128A, VAL141A, VAL180D, VAL192D, VAL20D, VAL96A
• B-C: ALA156B, ALA156C, ALA159B, ALA159C, ALA160B, ALA160C, ARG130B, ARG130C, ARG177B, ARG177C, ARG200B, ARG200C, ARG211B, ARG211C, ARG214B, ARG214C, ARG215B, ARG215C, ARG216B, ARG216C, ASN164B, ASN164C, ASN172B, ASN172C, ASN28B, ASN28C, ASP117B, ASP117C, ASP118B, ASP118C, ASP153B, ASP153C, ASP155B, ASP155C, ASP157B, ASP157C, ASP207B, ASP207C, ASP29B, ASP29C, ASP31B, ASP31C, GLN109B, GLN109C, GLN204B, GLN204C, GLN27B, GLN27C, GLU169B, GLU169C, GLU176B, GLU176C, GLU203B, GLU203C, GLU210B, GLU210C, GLY171B, GLY171C, GLY212B, GLY212C, HIS131B, HIS131C, HIS173B, HIS173C, ILE145B, ILE145C, ILE202B, ILE202C, ILE206B, ILE206C, ILE208B, ILE208C, ILE98B, ILE98C, LEU115B, LEU115C, LEU150B, LEU150C, LEU154B, LEU154C, LEU163B, LEU163C, LEU170B, LEU170C, LEU174B, LEU174C, LEU209B, LEU209C, LEU94B, LEU94C, LYS113B, LYS113C, LYS138B, LYS138C, PHE134B, PHE134C, PHE161B, PHE161C, PHE167B, PHE167C, PHE178B, PHE178C, PHE87B, PHE87C, PRO152B, PRO152C, PRO182C, SER32B, SER32C, THR158B, THR158C, THR168B, THR168C, TYR112B, TYR112C, TYR116B, TYR116C, TYR30B, TYR30C, VAL119B, VAL141B, VAL141C, VAL151B, VAL151C, VAL162B, VAL162C, VAL165B, VAL165C, VAL166B, VAL166C, VAL201B, VAL201C, VAL205B, VAL205C, VAL33B, VAL33C
• C-D: ARG76D, GLN77D, GLU11C, GLU12C, LYS13C, PRO10C, PRO79D, PRO80D, THR78D
• D-E: ALA156D, ALA156E, ALA159D, ALA159E, ALA160D, ALA160E, ARG130D, ARG130E, ARG177D, ARG177E, ARG200D, ARG200E, ARG211D, ARG211E, ARG214D, ARG214E, ARG215D, ARG215E, ARG216D, ARG216E, ASN164D, ASN164E, ASN172D, ASN172E, ASN28D, ASN28E, ASP117D, ASP117E, ASP118D, ASP118E, ASP153D, ASP153E, ASP155D, ASP155E, ASP157D, ASP157E, ASP207D, ASP207E, ASP29D, ASP29E, ASP31D, ASP31E, GLN109D, GLN109E, GLN204D, GLN204E, GLN27D, GLN27E, GLU169D, GLU169E, GLU176D, GLU176E, GLU203D, GLU203E, GLU210D, GLU210E, GLY171D, GLY171E, GLY212D, GLY212E, HIS131D, HIS131E, HIS173D, HIS173E, ILE202D, ILE202E, ILE206D, ILE206E, ILE208D, ILE208E, ILE98D, ILE98E, LEU115D, LEU115E, LEU150D, LEU150E, LEU154D, LEU154E, LEU163D, LEU163E, LEU170D, LEU170E, LEU174D, LEU174E, LEU209D, LEU209E, LEU94D, LEU94E, LYS113D, LYS113E, LYS138D, LYS138E, PHE134D, PHE134E, PHE161D, PHE161E, PHE167D, PHE167E, PHE178D, PHE178E, PHE87D, PHE87E, PRO152D, PRO152E, SER32D, SER32E, THR158D, THR158E, THR168D, THR168E, TYR112D, TYR112E, TYR116D, TYR116E, TYR30D, TYR30E, VAL119E, VAL141D, VAL141E, VAL151D, VAL151E, VAL162D, VAL162E, VAL165D, VAL165E, VAL166D, VAL166E, VAL201D, VAL201E, VAL205D, VAL205E, VAL33D, VAL33E