1WN3

crystal structure of tt0310 protein from thermus thermophilus hb8

• Total interactions analyzed: 28
• Total true interactions: 17
• Strongest Interaction:
  • Chains: E-G
  • Int. Res.: 125
  • Norm. En. per Res.: -4.5656
• Hub Node: A(5)

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	-11.6367	17.8072	-144.977	-138.8065	65	3	4	5958	0	10	15
A-C	-99.1477	-50.5995	-403.69	-553.4372	125	10	11	14006	5	30	19
A-D	0.0	27.4219	-45.8029	-18.381	43	2	1	2554	0	2	10
A-F	0.0	-0.7604	-19.2378	-19.9982	22	1	0	1064	0	8	9
A-H	0.0	0.0	-10.0672	-10.0672	23	0	1	796	0	5	6
B-C	0.0	30.1833	-43.3188	-13.1355	43	3	1	2545	0	2	10
B-D	-101.6878	-47.8122	-404.802	-554.302	125	14	10	13808	5	31	22
C-D	-22.6013	16.2857	-147.374	-153.6895	65	3	2	6074	0	11	15
C-F	0.0	0.0	-0.2257	-0.2257	5	0	0	45	0	2	0
C-H	-7.8664	-3.7901	-29.6667	-41.3232	19	1	1	1178	1	5	6
D-H	-2.3322	-30.388	-3.1036	-35.8238	14	1	0	384	3	5	5
E-F	-18.5701	19.2316	-142.224	-141.5625	65	6	4	5973	0	13	15
E-G	-111.3446	-46.5187	-412.839	-570.7024	125	15	12	14249	3	27	16
E-H	0.0	29.1253	-44.0331	-14.9078	42	1	1	2514	0	2	10
F-G	0.0	25.3907	-42.1928	-16.8022	44	1	1	2448	0	2	10
F-H	-110.0575	-47.138	-420.341	-577.5364	131	18	11	14692	4	31	23
G-H	-6.5491	12.9636	-142.155	-135.7405	67	4	4	5891	0	11	13

Interface residues

• A-B: ALA108A, ALA108B, ALA94A, ALA94B, ARG67A, ARG67B, ARG72A, ARG72B, ARG97A, ARG97B, ASN88A, ASN88B, ASP69A, ASP69B, CYS66A, CYS66B, GLU86A, GLU86B, GLU99A, GLU99B, GLY112A, GLY112B, LEU106A, LEU106B, LEU109A, LEU109B, LEU64A, LEU64B, LEU89A, LEU89B, MET68A, MET68B, PHE110A, PHE110B, PHE51A, PHE51B, PHE71A, PHE71B, SER65A, SER65B, SER90A, SER90B, THR111A, THR111B, THR113A, THR113B, THR93A, THR93B, THR95A, THR95B, TYR44A, TYR44B, TYR70A, TYR70B, TYR96A, TYR96B, VAL107A, VAL107B, VAL114A, VAL114B, VAL85A, VAL85B, VAL87A, VAL87B, VAL98B
• A-C: ALA108A, ALA108C, ALA29A, ALA29C, ALA38A, ALA38C, ALA45A, ALA45C, ALA47A, ALA47C, ALA50A, ALA50C, ALA52A, ALA52C, ALA54A, ALA61A, ALA61C, ALA63A, ALA63C, ALA8A, ALA8C, ARG28A, ARG28C, ARG2A, ARG67A, ARG67C, ARG72A, ASN33A, ASN33C, ASN56A, ASN56C, ASP30A, ASP30C, ASP3A, ASP3C, ASP48A, ASP48C, ASP69A, ASP69C, CYS66A, CYS66C, GLU7A, GLU7C, GLY112A, GLY112C, GLY36A, GLY36C, GLY40A, GLY40C, GLY41A, GLY41C, GLY59A, GLY59C, HIS31A, HIS31C, HIS35A, HIS35C, HIS39A, HIS39C, LEU109A, LEU109C, LEU117A, LEU117C, LEU11A, LEU11C, LEU16A, LEU32A, LEU32C, LEU34A, LEU34C, LEU43A, LEU43C, LEU46A, LEU46C, LEU53A, LEU53C, LEU64A, LEU64C, LEU9A, LEU9C, MET68A, MET68C, MET6A, MET6C, PHE110A, PHE110C, PHE42A, PHE42C, PHE51A, PHE51C, PHE5A, PHE5C, PHE71A, PHE71C, PRO4A, PRO4C, PRO60A, PRO60C, PRO73A, PRO73C, SER49A, SER49C, SER55A, SER55C, SER65A, SER65C, THR111A, THR111C, THR113A, THR113C, THR37A, THR37C, TYR44A, TYR44C, TYR70A, TYR70C, VAL114A, VAL114C, VAL13A, VAL13C, VAL23A, VAL23C, VAL27C, VAL62A, VAL62C
• A-D: ALA63D, ALA94A, ALA94D, ARG116A, ARG116D, ARG67A, ARG67D, ARG91A, ARG91D, ARG92A, ARG92D, ASN88A, ASN88D, ASP69A, ASP69D, CYS66A, CYS66D, GLY112A, GLY112D, LEU117A, LEU117D, LEU64A, LEU64D, MET68A, MET68D, PHE115A, PHE115D, SER65A, SER65D, SER90A, SER90D, THR111A, THR111D, THR113A, THR113D, THR93A, THR93D, THR95A, THR95D, VAL114A, VAL114D, VAL62A, VAL62D
• A-F: ALA29F, ALA8F, ARG116A, ARG28F, ARG2A, ARG58A, ARG91A, ARG92A, ASN56A, ASP30F, GLU7F, GLY10F, GLY59A, HIS31F, LEU117A, LEU16A, LEU32F, LEU53A, LEU9F, PRO4F, PRO60A, THR57A
• A-H: ALA29H, ALA61A, ALA8H, ARG116A, ARG28H, ARG2A, ARG2H, ARG92A, ASN56A, ASP30H, ASP3A, GLU7H, GLY10H, HIS31H, LEU117A, LEU9H, MET6H, PHE115A, PHE5H, PRO4A, PRO4H, PRO60A, VAL62A
• B-C: ALA63B, ALA94B, ALA94C, ARG116B, ARG116C, ARG67B, ARG67C, ARG91B, ARG91C, ARG92B, ARG92C, ASN88B, ASN88C, ASP69B, ASP69C, CYS66B, CYS66C, GLY112B, GLY112C, LEU117B, LEU117C, LEU64B, LEU64C, MET68B, MET68C, PHE115B, PHE115C, SER65B, SER65C, SER90B, SER90C, THR111B, THR111C, THR113B, THR113C, THR93B, THR93C, THR95B, THR95C, VAL114B, VAL114C, VAL62B, VAL62C
• B-D: ALA108B, ALA108D, ALA29B, ALA29D, ALA38B, ALA38D, ALA45B, ALA45D, ALA47B, ALA47D, ALA50B, ALA50D, ALA52B, ALA52D, ALA61B, ALA61D, ALA63B, ALA63D, ALA8B, ALA8D, ARG28B, ARG28D, ARG2B, ARG2D, ARG67B, ARG67D, ARG72B, ASN33B, ASN33D, ASN56B, ASN56D, ASP30B, ASP30D, ASP3B, ASP3D, ASP48B, ASP48D, ASP69B, ASP69D, CYS66B, CYS66D, GLU7B, GLU7D, GLY112B, GLY112D, GLY36B, GLY36D, GLY40B, GLY40D, GLY41B, GLY41D, GLY59B, GLY59D, HIS31B, HIS31D, HIS35B, HIS35D, HIS39B, HIS39D, LEU109B, LEU109D, LEU117B, LEU117D, LEU11B, LEU11D, LEU16B, LEU32B, LEU32D, LEU34B, LEU34D, LEU43B, LEU43D, LEU46B, LEU46D, LEU53B, LEU53D, LEU64B, LEU64D, LEU9B, LEU9D, MET68B, MET68D, MET6B, MET6D, PHE110B, PHE110D, PHE42B, PHE42D, PHE51B, PHE51D, PHE5B, PHE5D, PHE71B, PHE71D, PRO4B, PRO4D, PRO60B, PRO60D, PRO73B, PRO73D, SER49B, SER49D, SER55B, SER55D, SER65B, SER65D, THR111B, THR111D, THR113B, THR113D, THR37B, THR37D, TYR44B, TYR44D, TYR70B, TYR70D, VAL114B, VAL114D, VAL13B, VAL13D, VAL23B, VAL23D, VAL27D, VAL62B, VAL62D
• C-D: ALA108C, ALA108D, ALA94C, ALA94D, ARG67C, ARG67D, ARG72C, ARG72D, ARG97C, ARG97D, ASN88C, ASN88D, ASP69C, ASP69D, CYS66C, CYS66D, GLU86C, GLU86D, GLU99C, GLU99D, GLY112C, GLY112D, LEU106C, LEU106D, LEU109C, LEU109D, LEU64C, LEU64D, LEU89C, LEU89D, LYS105C, MET68C, MET68D, PHE110C, PHE110D, PHE51C, PHE51D, PHE71C, PHE71D, SER65C, SER65D, SER90C, SER90D, THR111C, THR111D, THR113C, THR113D, THR93C, THR93D, THR95C, THR95D, TYR44C, TYR44D, TYR70C, TYR70D, TYR96C, TYR96D, VAL107C, VAL107D, VAL114C, VAL114D, VAL85C, VAL87C, VAL87D, VAL98C
• C-F: ALA8F, GLU7F, HIS35C, LEU34C, PRO4F
• C-H: ALA29H, ALA76C, ALA76H, ARG28H, ARG79H, ASN33C, ASP30H, GLU26H, GLY10H, GLY36C, GLY75C, GLY77H, HIS31H, HIS35C, LEU32C, LEU34C, PRO73C, THR37C, VAL27H
• D-H: ARG116D, ARG2H, ARG91D, ARG92D, ASP3H, GLU7H, LEU117D, LEU11H, LYS12H, MET1H, MET6H, PHE115D, PRO4H, VAL13H
• E-F: ALA108E, ALA108F, ALA94E, ALA94F, ARG67E, ARG67F, ARG72E, ARG72F, ARG97E, ARG97F, ASN88E, ASN88F, ASP69E, ASP69F, CYS66E, CYS66F, GLU86E, GLU86F, GLU99E, GLU99F, GLY112E, GLY112F, LEU106E, LEU106F, LEU109E, LEU109F, LEU64E, LEU64F, LEU89E, LEU89F, MET68E, MET68F, PHE110E, PHE110F, PHE51E, PHE51F, PHE71E, PHE71F, SER65E, SER65F, SER90E, SER90F, THR111E, THR111F, THR113E, THR113F, THR93E, THR93F, THR95E, THR95F, TYR44E, TYR44F, TYR70E, TYR70F, TYR96E, TYR96F, VAL107E, VAL107F, VAL114E, VAL114F, VAL85E, VAL85F, VAL87E, VAL87F, VAL98F
• E-G: ALA108E, ALA108G, ALA29E, ALA29G, ALA38E, ALA38G, ALA45E, ALA45G, ALA47E, ALA47G, ALA50E, ALA50G, ALA52E, ALA52G, ALA54E, ALA61E, ALA61G, ALA63E, ALA63G, ALA8E, ALA8G, ARG28E, ARG28G, ARG67E, ARG67G, ARG72E, ASN33E, ASN33G, ASN56E, ASN56G, ASP30E, ASP30G, ASP3E, ASP3G, ASP48E, ASP48G, ASP69E, ASP69G, CYS66E, CYS66G, GLU7E, GLU7G, GLY112E, GLY112G, GLY36E, GLY36G, GLY40E, GLY40G, GLY41E, GLY41G, GLY59E, GLY59G, HIS31E, HIS31G, HIS35E, HIS35G, HIS39E, HIS39G, LEU109E, LEU109G, LEU117E, LEU117G, LEU11E, LEU11G, LEU16E, LEU16G, LEU32E, LEU32G, LEU34E, LEU34G, LEU43E, LEU43G, LEU46E, LEU46G, LEU53E, LEU53G, LEU64E, LEU64G, LEU9E, LEU9G, MET68E, MET68G, MET6E, MET6G, PHE110E, PHE110G, PHE115E, PHE42E, PHE42G, PHE51E, PHE51G, PHE5E, PHE5G, PHE71E, PHE71G, PRO4E, PRO4G, PRO60E, PRO60G, PRO73E, PRO73G, SER49E, SER49G, SER55E, SER55G, SER65E, SER65G, THR111E, THR111G, THR113E, THR113G, THR37E, THR37G, TYR44E, TYR44G, TYR70E, TYR70G, VAL114E, VAL114G, VAL13E, VAL13G, VAL23E, VAL23G, VAL62E, VAL62G
• E-H: ALA94E, ALA94H, ARG116E, ARG116H, ARG67E, ARG67H, ARG91E, ARG91H, ARG92E, ARG92H, ASN88E, ASN88H, ASP69E, ASP69H, CYS66E, CYS66H, GLY112E, GLY112H, LEU117E, LEU117H, LEU64E, LEU64H, MET68E, MET68H, PHE115E, PHE115H, SER65E, SER65H, SER90E, SER90H, THR111E, THR111H, THR113E, THR113H, THR93E, THR93H, THR95E, THR95H, VAL114E, VAL114H, VAL62E, VAL62H
• F-G: ALA63F, ALA63G, ALA94F, ALA94G, ARG116F, ARG116G, ARG67F, ARG67G, ARG91F, ARG91G, ARG92F, ARG92G, ASN88F, ASN88G, ASP69F, ASP69G, CYS66F, CYS66G, GLY112F, GLY112G, LEU117F, LEU117G, LEU64F, LEU64G, MET68F, MET68G, PHE115F, PHE115G, SER65F, SER65G, SER90F, SER90G, THR111F, THR111G, THR113F, THR113G, THR93F, THR93G, THR95F, THR95G, VAL114F, VAL114G, VAL62F, VAL62G
• F-H: ALA108F, ALA108H, ALA29F, ALA29H, ALA38F, ALA38H, ALA45F, ALA45H, ALA47F, ALA47H, ALA50F, ALA50H, ALA52F, ALA52H, ALA54F, ALA54H, ALA61F, ALA61H, ALA63F, ALA63H, ALA8F, ALA8H, ARG28F, ARG28H, ARG2F, ARG2H, ARG67F, ARG67H, ARG72F, ASN33F, ASN33H, ASN56F, ASN56H, ASP30F, ASP30H, ASP3F, ASP3H, ASP48F, ASP48H, ASP69F, ASP69H, CYS66F, CYS66H, GLU7F, GLU7H, GLY112F, GLY112H, GLY36F, GLY36H, GLY40F, GLY40H, GLY41F, GLY41H, GLY59F, GLY59H, HIS31F, HIS31H, HIS35F, HIS35H, HIS39F, HIS39H, LEU109F, LEU109H, LEU117F, LEU117H, LEU11F, LEU11H, LEU16H, LEU32F, LEU32H, LEU34F, LEU34H, LEU43F, LEU43H, LEU46F, LEU46H, LEU53F, LEU53H, LEU64F, LEU64H, LEU9F, LEU9H, MET1H, MET68F, MET68H, MET6F, MET6H, PHE110F, PHE110H, PHE115F, PHE42F, PHE42H, PHE51F, PHE51H, PHE5F, PHE5H, PHE71F, PHE71H, PRO4F, PRO4H, PRO60F, PRO60H, PRO73F, PRO73H, SER49F, SER49H, SER55F, SER55H, SER65F, SER65H, THR111F, THR111H, THR113F, THR113H, THR37F, THR37H, THR57F, TYR44F, TYR44H, TYR70F, TYR70H, VAL114F, VAL114H, VAL13F, VAL13H, VAL23F, VAL23H, VAL27F, VAL27H, VAL62F, VAL62H
• G-H: ALA108G, ALA108H, ALA94G, ALA94H, ARG67G, ARG67H, ARG72G, ARG72H, ARG97G, ARG97H, ASN88G, ASN88H, ASP69G, ASP69H, CYS66G, CYS66H, GLU86G, GLU86H, GLU99G, GLU99H, GLY112G, GLY112H, LEU106G, LEU106H, LEU109G, LEU109H, LEU64G, LEU64H, LEU89G, LEU89H, LYS105G, MET68G, MET68H, PHE110G, PHE110H, PHE51G, PHE51H, PHE71G, PHE71H, SER65G, SER65H, SER90G, SER90H, THR111G, THR111H, THR113G, THR113H, THR93G, THR93H, THR95G, THR95H, TYR44G, TYR44H, TYR70G, TYR70H, TYR96G, TYR96H, VAL107G, VAL107H, VAL114G, VAL114H, VAL85G, VAL85H, VAL87G, VAL87H, VAL98G, VAL98H