1VEL

mycobacterium smegmatis dps tetragonal form

• Total interactions analyzed: 15
• Total true interactions: 9
• Strongest Interaction:
  • Chains: C-E
  • Int. Res.: 135
  • Norm. En. per Res.: -3.5829
• 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	-12.1074	-53.8138	-191.582	-257.5032	76	10	6	7980	5	21	27
A-C	-10.801	-50.5518	-194.532	-255.8848	82	12	6	8142	5	20	28
B-C	-16.7888	-45.6729	-177.243	-239.7047	77	7	6	7875	5	21	26
B-E	-9.2973	-11.4961	-127.887	-148.6804	52	3	5	4875	1	8	10
C-D	-30.0706	-10.3907	-137.987	-178.4483	52	11	6	5101	0	9	10
C-E	-52.2504	-65.7926	-365.642	-483.685	135	23	1	14960	9	66	61
D-E	-8.7469	-46.8745	-173.821	-229.4424	78	8	6	7807	5	21	27
D-F	-23.6719	-59.8844	-178.775	-262.3313	76	9	6	7765	6	20	28
E-F	-7.92	-58.8893	-187.454	-254.2633	78	10	6	7806	5	19	26

Interface residues

• A-B: ALA140A, ALA142A, ALA14B, ALA154A, ALA159A, ALA69B, ALA73B, ARG121A, ARG153A, ARG71B, ASN114A, ASP110A, ASP119A, ASP131B, ASP136A, ASP136B, ASP66B, GLN135A, GLN135B, GLN149A, GLN162A, GLU118A, GLU125A, GLU128A, GLU128B, GLU144A, GLU146A, GLU157A, GLU67B, GLU70B, GLY115A, GLY143A, GLY160A, GLY161A, GLY63B, GLY76B, GLY8B, HIS141A, ILE117A, ILE124A, ILE139A, ILE139B, ILE6B, ILE72B, LEU111A, LEU130B, LEU132A, LEU132B, LEU137B, LEU138A, LEU145A, LEU163A, LEU75B, LEU9B, LYS122A, LYS13B, LYS147A, LYS77B, PHE148A, PHE151A, PHE4B, PRO79B, PRO7B, SER134B, SER158A, SER3B, SER78B, THR120A, THR5B, THR74B, TRP150A, TYR113A, VAL116A, VAL133B, VAL17B, VAL68B
• A-C: ALA140C, ALA142C, ALA14A, ALA154C, ALA69A, ALA73A, ARG121C, ARG153C, ARG71A, ASN114C, ASP110C, ASP119C, ASP129A, ASP131A, ASP136A, ASP136C, ASP66A, GLN135A, GLN135C, GLN149C, GLN162C, GLU118C, GLU125C, GLU128A, GLU128C, GLU144C, GLU146C, GLU157C, GLU67A, GLU70A, GLY115C, GLY143C, GLY160C, GLY161C, GLY76A, GLY8A, HIS141C, HIS165C, ILE117C, ILE124C, ILE139A, ILE139C, ILE6A, ILE72A, LEU111C, LEU127C, LEU130A, LEU132A, LEU132C, LEU137A, LEU137C, LEU138C, LEU145C, LEU156C, LEU163C, LEU75A, LEU9A, LYS122C, LYS126C, LYS13A, LYS147C, LYS77A, PHE148C, PHE151C, PHE4A, PRO79A, PRO7A, SER10A, SER134A, SER158C, SER3A, SER78A, THR120C, THR5A, THR74A, TRP150C, TYR113C, VAL112C, VAL116C, VAL133A, VAL17A, VAL68A
• B-C: ALA140B, ALA142B, ALA14C, ALA154B, ALA159B, ALA69C, ALA73C, ARG121B, ARG153B, ARG71C, ASN114B, ASP110B, ASP119B, ASP131C, ASP136B, ASP136C, ASP66C, GLN135B, GLN135C, GLN149B, GLN162B, GLU118B, GLU125B, GLU128B, GLU128C, GLU144B, GLU146B, GLU157B, GLU67C, GLU70C, GLY115B, GLY143B, GLY160B, GLY161B, GLY76C, GLY8C, HIS141B, HIS165B, ILE117B, ILE124B, ILE139B, ILE139C, ILE6C, ILE72C, LEU111B, LEU130C, LEU132B, LEU132C, LEU137C, LEU138B, LEU145B, LEU163B, LEU75C, LEU9C, LYS122B, LYS13C, LYS147B, LYS77C, PHE148B, PHE151B, PHE4C, PRO79C, PRO7C, SER10C, SER134C, SER158B, SER3C, SER78C, THR120B, THR5C, THR74C, TRP150B, TYR113B, VAL112B, VAL116B, VAL133C, VAL17C
• B-E: ALA104E, ALA154B, ALA159B, ARG153B, ARG99E, ASN41E, ASN46B, ASN46E, ASP100E, GLN103B, GLN162B, GLU157B, GLU52B, GLU52E, GLU98E, GLY160B, GLY161B, GLY44E, GLY49B, GLY49E, HIS105E, HIS155B, HIS39E, HIS51B, HIS51E, ILE48B, ILE48E, ILE54B, LEU106B, LEU156B, LEU163B, LYS147B, MET53B, PHE148B, PHE151B, PHE47B, PHE47E, PRO45B, PRO45E, PRO56B, SER158B, THR101E, THR164B, TRP150B, TRP40E, VAL102B, VAL102E, VAL152B, VAL42E, VAL43E, VAL50B, VAL50E
• C-D: ALA104C, ALA154D, ALA159D, ARG153D, ARG99C, ASN41C, ASN46C, ASN46D, ASP100C, GLN103C, GLN103D, GLN162D, GLU157D, GLU52C, GLU52D, GLU98C, GLY160D, GLY161D, GLY44C, GLY49C, GLY49D, HIS155D, HIS39C, HIS51C, HIS51D, ILE48C, ILE48D, ILE54D, LEU106D, LEU156D, LEU163D, LYS147D, MET53D, PHE148D, PHE151D, PHE47C, PHE47D, PRO45C, PRO45D, PRO56D, SER158D, THR101C, TRP150D, TRP40C, VAL102C, VAL102D, VAL152D, VAL38C, VAL42C, VAL43C, VAL50C, VAL50D
• C-E: ALA65C, ALA65E, ALA69C, ALA69E, ALA73C, ALA73E, ALA85C, ALA85E, ARG62C, ARG62E, ARG71C, ARG71E, ARG90C, ARG90E, ARG99C, ARG99E, ASN29C, ASN29E, ASN41C, ASN41E, ASP100C, ASP100E, ASP30C, ASP30E, ASP55C, ASP55E, ASP66C, ASP66E, ASP93C, ASP93E, ASP94C, ASP94E, GLN22C, GLN22E, GLU59C, GLU59E, GLU67C, GLU67E, GLU70C, GLU70E, GLU98C, GLU98E, GLY63C, GLY63E, GLY76C, GLY76E, GLY81C, GLY81E, GLY84C, GLY84E, HIS105C, HIS105E, HIS32C, HIS32E, HIS37C, HIS37E, HIS39C, HIS39E, HIS51C, HIS51E, ILE72C, ILE72E, ILE86C, ILE86E, ILE87C, ILE87E, LEU25C, LEU25E, LEU31C, LEU31E, LEU33C, LEU33E, LEU35C, LEU35E, LEU75C, LEU75E, LYS36C, LYS36E, LYS77C, LYS77E, LYS80C, LYS80E, LYS88C, LYS88E, MET1E, PHE47C, PHE47E, PHE4C, PHE4E, PRO79C, PRO79E, PRO83C, PRO83E, SER26C, SER26E, SER3C, SER3E, SER78C, SER78E, SER96C, SER96E, THR27C, THR27E, THR2E, THR34C, THR34E, THR5C, THR74C, THR74E, THR82C, THR82E, TRP40C, TRP40E, TRP92C, TRP92E, TYR28C, TYR28E, TYR64C, TYR64E, TYR95C, TYR95E, VAL38C, VAL38E, VAL42C, VAL42E, VAL43C, VAL43E, VAL58C, VAL58E, VAL61C, VAL61E, VAL68C, VAL68E, VAL97C, VAL97E
• D-E: ALA140D, ALA142D, ALA14E, ALA154D, ALA69E, ALA73E, ARG121D, ARG153D, ARG71E, ASN114D, ASP110D, ASP119D, ASP131E, ASP136D, ASP136E, ASP66E, GLN135D, GLN135E, GLN149D, GLN162D, GLU118D, GLU125D, GLU128D, GLU128E, GLU144D, GLU146D, GLU157D, GLU67E, GLU70E, GLY115D, GLY143D, GLY160D, GLY161D, GLY76E, GLY8E, HIS141D, HIS165D, ILE117D, ILE124D, ILE139D, ILE139E, ILE6E, ILE72E, LEU111D, LEU130E, LEU132D, LEU132E, LEU137E, LEU138D, LEU145D, LEU156D, LEU163D, LEU75E, LEU9E, LYS122D, LYS13E, LYS147D, LYS77E, MET1E, PHE148D, PHE151D, PHE4E, PRO79E, PRO7E, SER134E, SER158D, SER3E, SER78E, THR120D, THR164D, THR2E, THR5E, THR74E, TRP150D, TYR113D, VAL116D, VAL133E, VAL17E
• D-F: ALA140F, ALA142F, ALA14D, ALA154F, ALA69D, ALA73D, ARG121F, ARG153F, ARG71D, ASN114F, ASP110F, ASP119F, ASP131D, ASP136D, ASP136F, ASP66D, GLN135D, GLN135F, GLN149F, GLN162F, GLU118F, GLU125F, GLU128D, GLU128F, GLU144F, GLU146F, GLU157F, GLU67D, GLU70D, GLY115F, GLY143F, GLY160F, GLY161F, GLY76D, GLY8D, HIS141F, HIS165F, ILE117F, ILE124F, ILE139D, ILE139F, ILE6D, ILE72D, LEU111F, LEU130D, LEU132D, LEU132F, LEU137D, LEU138F, LEU145F, LEU163F, LEU75D, LEU9D, LYS122F, LYS13D, LYS147F, LYS77D, PHE148F, PHE151F, PHE4D, PRO79D, PRO7D, SER10D, SER134D, SER158F, SER3D, SER78D, THR120F, THR5D, THR74D, TRP150F, TYR113F, VAL116F, VAL133D, VAL17D, VAL68D
• E-F: ALA140E, ALA142E, ALA154E, ALA69F, ALA73F, ARG121E, ARG153E, ARG71F, ASN114E, ASP110E, ASP119E, ASP131F, ASP136E, ASP136F, ASP66F, GLN135E, GLN135F, GLN149E, GLN162E, GLU118E, GLU125E, GLU128E, GLU128F, GLU144E, GLU146E, GLU157E, GLU67F, GLU70F, GLY115E, GLY143E, GLY160E, GLY161E, GLY76F, GLY8F, HIS141E, HIS165E, ILE117E, ILE124E, ILE139E, ILE139F, ILE6F, ILE72F, LEU111E, LEU127E, LEU130F, LEU132E, LEU132F, LEU137E, LEU137F, LEU138E, LEU145E, LEU163E, LEU75F, LEU9F, LYS122E, LYS13F, LYS147E, LYS77F, PHE148E, PHE151E, PHE4F, PRO79F, PRO7F, SER10F, SER134F, SER158E, SER3F, SER78F, THR120E, THR164E, THR5F, THR74F, TRP150E, TYR113E, VAL112E, VAL116E, VAL133F, VAL17F