3DD9

structure of doch66y dimer

• Total interactions analyzed: 28
• Total true interactions: 11
• Strongest Interaction:
  • Chains: E-F
  • Int. Res.: 200
  • Norm. En. per Res.: -4.2735
• 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	-20.5405	-61.2108	-754.913	-836.6643	209	23	62	31351	4	29	25
A-C	0.0	0.0	-0.1473	-0.1473	9	0	0	43	0	3	8
B-C	0.0	2.2875	-22.7178	-20.4303	24	0	1	1008	0	8	6
B-H	-20.981	4.732	-86.1742	-102.4231	51	5	1	4399	0	16	12
C-D	-35.0711	-77.451	-740.824	-853.3461	211	28	63	30984	5	33	24
D-E	-7.813	4.0322	-90.3287	-94.1095	38	7	0	3578	0	9	5
D-F	0.0	0.0	-0.0349	-0.0349	3	0	0	15	0	0	0
E-F	-36.6152	-86.0858	-732.004	-854.7049	200	25	61	30221	6	26	20
E-G	0.0	0.0	-18.5699	-18.5699	18	1	1	784	0	6	4
F-G	0.0	0.0	-0.2322	-0.2322	9	0	0	58	0	2	7
G-H	-26.7563	-74.9758	-750.423	-852.155	209	19	61	30959	5	32	29

Interface residues

• A-B: ALA104A, ALA104B, ALA105A, ALA105B, ALA115A, ALA115B, ALA11A, ALA11B, ALA15A, ALA32A, ALA32B, ALA34A, ALA34B, ALA41A, ALA41B, ALA44A, ALA44B, ALA56A, ALA56B, ALA61A, ALA61B, ALA63A, ALA63B, ALA71A, ALA71B, ALA76A, ALA76B, ALA80A, ALA80B, ALA98A, ALA98B, ARG119A, ARG119B, ARG120A, ARG120B, ARG2A, ARG2B, ARG31A, ARG31B, ARG42A, ARG42B, ARG64A, ARG64B, ARG74A, ARG74B, ARG85A, ARG85B, ARG86A, ARG86B, ASN16A, ASN69A, ASN69B, ASN72A, ASN72B, ASN78A, ASN78B, ASN87A, ASN87B, ASP116A, ASP116B, ASP14A, ASP14B, ASP28A, ASP28B, ASP50A, ASP50B, ASP70A, ASP70B, ASP99B, GLN40A, GLN40B, GLN90A, GLN90B, GLU108A, GLU108B, GLU33A, GLU33B, GLU46B, GLU53A, GLU53B, GLU7A, GLU7B, GLU8A, GLU8B, GLY103A, GLY103B, GLY107A, GLY107B, GLY123A, GLY123B, GLY30A, GLY30B, GLY37A, GLY37B, GLY65A, GLY65B, GLY88A, GLY88B, HIS13A, HIS13B, HIS3A, HIS3B, ILE109A, ILE109B, ILE10A, ILE10B, ILE17A, ILE17B, ILE35A, ILE35B, ILE36A, ILE36B, ILE48A, ILE48B, ILE4A, ILE4B, ILE67A, ILE67B, LEU100A, LEU100B, LEU118A, LEU118B, LEU121A, LEU121B, LEU12A, LEU12B, LEU51A, LEU51B, LEU59A, LEU59B, LEU77A, LEU77B, LEU81A, LEU81B, LEU82A, LEU82B, LEU84A, LEU84B, LEU97A, LEU97B, LEU9A, LEU9B, LYS73A, LYS73B, MET1A, MET1B, PHE52A, PHE52B, PHE68A, PHE68B, PHE83A, PHE83B, PRO29A, PRO29B, PRO6A, PRO6B, SER110A, SER110B, SER112A, SER112B, SER113A, SER113B, SER124A, SER124B, SER27B, SER55A, SER55B, SER5A, SER5B, SER79A, SER79B, THR101A, THR101B, THR106A, THR106B, THR117A, THR117B, THR49A, THR49B, THR57A, THR57B, THR62A, THR62B, THR75A, THR75B, TYR122A, TYR122B, TYR58A, TYR58B, TYR66A, TYR66B, VAL102A, VAL102B, VAL111A, VAL111B, VAL114A, VAL114B, VAL39A, VAL39B, VAL43A, VAL43B, VAL54A, VAL54B, VAL60A, VAL60B, VAL89A, VAL89B, VAL91A, VAL91B
• A-C: ARG120C, ARG2A, GLU7A, HIS13A, ILE109C, ILE17A, SER113C, THR117C, TYR45C
• B-C: ALA41C, ALA44C, ALA71B, ARG19B, ARG31B, ARG38C, ARG42C, ARG64C, ARG74B, ASN69B, ASN72B, ASP28B, ASP70B, GLN40C, GLU108C, GLU46C, GLU47C, ILE109C, PHE68B, PRO29B, SER18B, SER27B, TYR45C, VAL43C
• B-H: ALA11B, ALA125H, ALA15B, ALA80B, ARG119H, ARG120H, ARG2B, ARG74B, ARG85B, ARG86B, ASN16B, ASN78B, ASN87B, ASP116H, ASP126H, ASP93B, GLN90B, GLN90H, GLU129H, GLU7B, GLU8B, GLU96H, GLY123H, GLY88B, ILE4B, LEU118H, LEU121H, LEU128H, LEU12B, LEU77B, LEU81B, LEU82B, LEU84B, LEU97B, LEU9B, PHE83B, PHE92B, PHE92H, PRO127H, SER124H, SER5B, SER79B, SER94B, SER94H, THR117H, THR75B, TYR122B, TYR122H, VAL89B, VAL91B, VAL91H
• C-D: ALA104C, ALA104D, ALA105C, ALA105D, ALA115C, ALA115D, ALA11C, ALA11D, ALA125D, ALA32C, ALA32D, ALA34C, ALA34D, ALA41C, ALA41D, ALA44C, ALA44D, ALA56C, ALA56D, ALA61C, ALA61D, ALA63C, ALA63D, ALA71C, ALA71D, ALA76C, ALA76D, ALA80C, ALA80D, ALA98C, ALA98D, ARG119C, ARG119D, ARG120C, ARG120D, ARG2C, ARG2D, ARG31C, ARG31D, ARG42C, ARG42D, ARG64C, ARG64D, ARG74C, ARG74D, ARG85C, ARG85D, ARG86C, ARG86D, ASN16C, ASN16D, ASN69C, ASN69D, ASN72C, ASN72D, ASN78C, ASN78D, ASN87C, ASN87D, ASP116C, ASP116D, ASP14C, ASP14D, ASP28D, ASP50C, ASP50D, ASP70C, ASP70D, GLN40C, GLN40D, GLN90C, GLN90D, GLU108C, GLU108D, GLU33C, GLU33D, GLU46C, GLU46D, GLU47C, GLU53C, GLU53D, GLU7C, GLU7D, GLU8C, GLU8D, GLY103C, GLY103D, GLY107C, GLY107D, GLY123C, GLY123D, GLY21C, GLY30C, GLY30D, GLY37C, GLY37D, GLY65C, GLY65D, GLY88C, GLY88D, HIS13C, HIS13D, HIS3C, HIS3D, ILE109C, ILE109D, ILE10C, ILE10D, ILE17C, ILE35C, ILE35D, ILE36C, ILE36D, ILE48C, ILE48D, ILE4C, ILE4D, ILE67C, ILE67D, LEU100C, LEU100D, LEU118C, LEU118D, LEU121C, LEU121D, LEU12C, LEU12D, LEU51C, LEU51D, LEU59C, LEU59D, LEU77C, LEU77D, LEU81C, LEU81D, LEU82C, LEU82D, LEU84C, LEU84D, LEU97C, LEU97D, LEU9C, LEU9D, LYS73C, LYS73D, MET1C, MET1D, MET26D, PHE52C, PHE52D, PHE68C, PHE68D, PHE83C, PHE83D, PRO29C, PRO29D, PRO6C, PRO6D, SER110C, SER110D, SER112C, SER112D, SER113C, SER113D, SER124C, SER124D, SER27D, SER55C, SER55D, SER5C, SER5D, SER79C, SER79D, THR101C, THR101D, THR106C, THR106D, THR117C, THR117D, THR49C, THR49D, THR57C, THR57D, THR62C, THR62D, THR75C, THR75D, TYR122C, TYR122D, TYR58C, TYR58D, TYR66C, TYR66D, VAL102C, VAL102D, VAL111C, VAL111D, VAL114C, VAL114D, VAL39C, VAL39D, VAL43C, VAL43D, VAL54C, VAL54D, VAL60C, VAL60D, VAL89C, VAL89D, VAL91C, VAL91D
• D-E: ALA11D, ALA15D, ARG119E, ARG120E, ARG2D, ARG85D, ARG86D, ASN78D, ASN87D, ASP116E, ASP93E, GLN90D, GLN90E, GLU7D, GLU8D, GLU96E, GLY123E, GLY88D, LEU118E, LEU121E, LEU12D, LEU81D, LEU82D, LEU84D, MET1D, PHE83D, PHE92E, PRO95E, SER113E, SER124E, SER5D, SER94E, THR117E, TYR122E, VAL89D, VAL89E, VAL91D, VAL91E
• D-F: ARG85D, ARG86D, PHE52F
• E-F: ALA104E, ALA104F, ALA105E, ALA105F, ALA115E, ALA115F, ALA11E, ALA11F, ALA32E, ALA32F, ALA34E, ALA34F, ALA41E, ALA41F, ALA44E, ALA44F, ALA56E, ALA56F, ALA61E, ALA61F, ALA63E, ALA63F, ALA71E, ALA71F, ALA76E, ALA76F, ALA80E, ALA80F, ALA98E, ALA98F, ARG119E, ARG119F, ARG120E, ARG120F, ARG2E, ARG2F, ARG31E, ARG31F, ARG42E, ARG64E, ARG64F, ARG74E, ARG74F, ARG85E, ARG85F, ARG86E, ARG86F, ASN69E, ASN69F, ASN72E, ASN72F, ASN78E, ASN78F, ASN87E, ASN87F, ASP116E, ASP116F, ASP14E, ASP14F, ASP50E, ASP50F, ASP70E, ASP70F, ASP99E, GLN40E, GLN40F, GLN90E, GLN90F, GLU108E, GLU108F, GLU33E, GLU33F, GLU46E, GLU53E, GLU53F, GLU7E, GLU7F, GLU8E, GLU8F, GLY103E, GLY103F, GLY107E, GLY107F, GLY123E, GLY123F, GLY30E, GLY30F, GLY37E, GLY37F, GLY65E, GLY65F, GLY88E, GLY88F, HIS13E, HIS13F, HIS3E, HIS3F, ILE109E, ILE109F, ILE10E, ILE10F, ILE17F, ILE35E, ILE35F, ILE36E, ILE36F, ILE48E, ILE48F, ILE4E, ILE4F, ILE67E, ILE67F, LEU100E, LEU100F, LEU118E, LEU118F, LEU121E, LEU121F, LEU12E, LEU12F, LEU51E, LEU51F, LEU59E, LEU59F, LEU77E, LEU77F, LEU81E, LEU81F, LEU82E, LEU82F, LEU84E, LEU84F, LEU97E, LEU97F, LEU9E, LEU9F, LYS73E, LYS73F, MET1E, MET1F, PHE52E, PHE52F, PHE68E, PHE68F, PHE83E, PHE83F, PRO29F, PRO6E, PRO6F, SER110E, SER110F, SER112E, SER112F, SER113E, SER113F, SER124E, SER55E, SER55F, SER5E, SER5F, SER79E, SER79F, THR101E, THR101F, THR106E, THR106F, THR117E, THR117F, THR49E, THR49F, THR57E, THR57F, THR62E, THR62F, THR75E, THR75F, TYR122E, TYR122F, TYR58E, TYR58F, TYR66E, TYR66F, VAL102E, VAL102F, VAL111E, VAL111F, VAL114E, VAL114F, VAL39E, VAL39F, VAL43E, VAL43F, VAL54E, VAL54F, VAL60E, VAL60F, VAL89E, VAL89F, VAL91E, VAL91F
• E-G: ALA41G, ALA44G, ALA71E, ARG31E, ARG42G, ASN69E, ASN72E, ASP70E, GLU108G, GLU46G, GLU47G, GLY30E, ILE48G, ILE67E, PHE68E, TYR45G, TYR66E, VAL43G
• F-G: ARG120G, ARG2F, GLU7F, HIS13F, ILE109G, ILE17F, SER113G, THR117G, TYR45G
• G-H: ALA104G, ALA104H, ALA105G, ALA105H, ALA115G, ALA115H, ALA11G, ALA11H, ALA125H, ALA32G, ALA32H, ALA34G, ALA34H, ALA41H, ALA44G, ALA44H, ALA56G, ALA56H, ALA61G, ALA61H, ALA63G, ALA63H, ALA71G, ALA71H, ALA76G, ALA76H, ALA80G, ALA80H, ALA98G, ALA98H, ARG119G, ARG119H, ARG120G, ARG120H, ARG2G, ARG2H, ARG31G, ARG31H, ARG42G, ARG42H, ARG64G, ARG64H, ARG74G, ARG74H, ARG85G, ARG85H, ARG86G, ARG86H, ASN16G, ASN16H, ASN69G, ASN69H, ASN72G, ASN72H, ASN78G, ASN78H, ASN87G, ASN87H, ASP116G, ASP116H, ASP14G, ASP14H, ASP28H, ASP50G, ASP50H, ASP70G, ASP70H, ASP99H, GLN40G, GLN40H, GLN90G, GLN90H, GLU108G, GLU108H, GLU33G, GLU33H, GLU46G, GLU46H, GLU47H, GLU53G, GLU53H, GLU7G, GLU7H, GLU8G, GLU8H, GLY103G, GLY103H, GLY107G, GLY107H, GLY123G, GLY123H, GLY30G, GLY30H, GLY37G, GLY37H, GLY65G, GLY65H, GLY88G, GLY88H, HIS13G, HIS13H, HIS3G, HIS3H, ILE109G, ILE109H, ILE10G, ILE10H, ILE17G, ILE17H, ILE35G, ILE35H, ILE36G, ILE36H, ILE48G, ILE48H, ILE4G, ILE4H, ILE67G, ILE67H, LEU100G, LEU100H, LEU118G, LEU118H, LEU121G, LEU121H, LEU12G, LEU12H, LEU51G, LEU51H, LEU59G, LEU59H, LEU77G, LEU77H, LEU81G, LEU81H, LEU82G, LEU82H, LEU84G, LEU84H, LEU97G, LEU97H, LEU9G, LEU9H, LYS73G, LYS73H, MET1G, MET1H, PHE52G, PHE52H, PHE68G, PHE68H, PHE83G, PHE83H, PRO29G, PRO29H, PRO6G, PRO6H, SER110G, SER110H, SER112G, SER112H, SER113G, SER113H, SER124G, SER124H, SER55G, SER55H, SER5G, SER5H, SER79G, SER79H, THR101G, THR101H, THR106G, THR106H, THR117G, THR117H, THR49G, THR49H, THR57G, THR57H, THR62G, THR62H, THR75G, THR75H, TYR122G, TYR122H, TYR58G, TYR58H, TYR66G, TYR66H, VAL102G, VAL102H, VAL111G, VAL111H, VAL114G, VAL114H, VAL39G, VAL39H, VAL43G, VAL43H, VAL54G, VAL54H, VAL60G, VAL60H, VAL89G, VAL89H, VAL91G, VAL91H