4A5M

redox regulator hypr in its oxidized form

• Total interactions analyzed: 28
• Total true interactions: 18
• Strongest Interaction:
  • Chains: A-E
  • Int. Res.: 65
  • Norm. En. per Res.: -2.3242
• Hub Node: A(6)

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	-10.1562	-13.797	1156.31	1132.3568	101	40	7	15967	0	25	19
A-D	0.0	-33.8898	-33.4692	-67.359	29	7	0	1799	1	15	12
A-E	0.0	-23.4767	-127.597	-151.0737	65	9	2	6247	11	29	27
A-F	0.0	0.0	-0.0365	-0.0365	4	0	0	13	0	1	0
A-G	0.0	0.0	-0.0841	-0.0841	3	0	0	14	0	2	1
A-H	-6.709	24.8768	-33.786	-15.6182	32	10	1	2555	4	20	20
B-C	0.0	0.0	-0.7995	-0.7995	10	0	0	179	0	0	2
B-D	0.0	-7.0024	-43.0042	-50.0066	47	13	3	3243	0	12	18
B-E	0.0	0.0	-0.0062	-0.0062	4	0	0	4	0	1	0
C-D	-2.2807	-23.5017	1266.56	1240.7776	103	25	7	15639	0	23	20
C-E	0.0	0.0	-0.1612	-0.1612	3	0	0	19	0	2	1
D-E	-8.6455	14.3266	-50.8688	-45.1876	33	9	1	2413	3	20	21
D-H	0.0	3.682	-0.5255	3.1565	2	0	0	57	0	0	1
E-F	-7.0645	-26.8863	1062.01	1028.0592	101	30	6	15710	1	25	21
E-H	0.0	-38.3306	-21.7136	-60.0442	32	12	0	1686	1	16	12
F-G	0.0	0.0	-1.0447	-1.0447	11	0	0	163	0	0	2
F-H	0.0	-7.9152	-40.0748	-47.99	44	17	3	2965	0	12	17
G-H	-14.13	-19.8558	1249.43	1215.4442	104	39	7	14734	2	23	18

Interface residues

• A-B: ARG108A, ARG108B, ARG47B, ARG91A, ARG91B, ASN107A, ASN107B, ASP109A, ASP109B, ASP21A, ASP21B, ASP67A, ASP67B, CYS14A, CYS14B, CYS49A, CYS49B, GLN99A, GLN99B, GLU102A, GLU102B, GLU105A, GLU105B, GLU17A, GLU17B, GLU94A, GLU94B, GLY104A, GLY104B, GLY24A, GLY24B, GLY25A, GLY25B, GLY29A, GLY29B, GLY90A, GLY90B, HIS34A, HIS34B, ILE23A, ILE23B, ILE30A, ILE30B, ILE36A, ILE36B, ILE48A, ILE48B, ILE52B, ILE69A, ILE69B, ILE96A, ILE96B, LEU20A, LEU20B, LEU31A, LEU31B, LEU93A, LEU93B, LEU98A, LEU98B, LYS101A, LYS101B, LYS26A, LYS26B, LYS28A, LYS28B, MET100A, MET100B, PHE18A, PHE18B, PHE32A, PHE32B, PHE89A, PHE89B, PRO15A, PRO15B, PRO50A, PRO50B, PRO95A, PRO95B, SER106A, SER106B, SER51A, SER51B, THR19A, THR19B, THR92A, THR92B, TRP103A, TRP103B, TRP27A, TRP27B, TYR33A, TYR33B, VAL110B, VAL16A, VAL16B, VAL22A, VAL22B, VAL97A, VAL97B
• A-D: ALA66A, ARG55D, ARG62D, ARG72D, ASP21A, ASP67A, CYS14A, GLN54D, GLU17A, GLU63A, GLU63D, GLU65D, GLY68A, ILE23A, LEU20A, LEU57D, LEU59D, MET56D, PHE18A, PHE42D, PHE89A, PRO15A, PRO80D, THR19A, THR53D, THR58D, VAL16A, VAL22A, VAL74D
• A-E: ALA66A, ALA66E, ARG41E, ARG46A, ARG46E, ARG55A, ARG55E, ARG62A, ARG62E, ARG72A, ARG72E, ASN43E, ASP21A, ASP21E, ASP67A, ASP67E, GLN54A, GLN54E, GLN60A, GLN60E, GLN77A, GLN77E, GLU63A, GLU63E, GLU65A, GLU65E, GLU73A, GLU73E, GLU83E, GLY68A, GLY68E, HIS76A, HIS76E, LEU59A, LEU59E, LEU61A, LEU61E, LEU64A, LEU64E, LYS28A, LYS28E, LYS81A, LYS81E, MET56A, MET56E, PHE42A, PHE42E, PRO79A, PRO79E, PRO80A, PRO80E, THR58A, THR58E, TYR75A, TYR75E, TYR84A, TYR84E, VAL22A, VAL22E, VAL74A, VAL74E, VAL78A, VAL78E, VAL82A, VAL82E
• A-F: HIS76A, LYS26F, VAL110F, VAL78A
• A-G: ASP109G, PRO79A, VAL78A
• A-H: ALA66H, ARG62H, ARG72H, ASP67H, GLN77A, GLU63H, GLU65H, GLU73A, GLU73H, GLU83A, GLU88H, GLY68H, GLY90H, HIS71A, HIS71H, HIS76A, ILE69H, LEU61H, LEU64H, LYS39A, LYS81A, PHE89H, PRO79A, PRO80A, SER85H, THR87H, TYR75A, TYR84H, VAL70H, VAL74A, VAL74H, VAL78A
• B-C: ARG46B, ARG55B, GLN54B, ILE52C, LYS26C, MET56C, SER51C, THR53B, THR53C, TRP27C
• B-D: ALA66D, ARG108B, ARG41D, ARG46D, ARG47B, ARG55D, ARG62D, ARG72D, ASN107B, ASN43D, ASP109B, CYS49B, GLN54D, GLN60D, GLU105B, GLU63D, GLU65D, GLU73D, GLU83D, HIS34B, ILE30B, ILE48B, ILE52B, LEU57D, LEU59D, LEU61D, LYS101B, LYS26B, LYS28D, LYS81D, MET56D, PHE42D, PHE45D, PRO50B, PRO79D, PRO80D, SER51B, THR53D, THR58D, TRP103B, TRP27B, TRP27D, TYR33B, TYR84D, VAL110B, VAL74D, VAL82D
• B-E: HIS76E, LYS26B, VAL110B, VAL78E
• C-D: ARG108C, ARG108D, ARG91C, ARG91D, ASN107C, ASN107D, ASP109C, ASP109D, ASP21C, ASP21D, ASP67C, ASP67D, CYS14C, CYS14D, CYS49C, CYS49D, GLN99C, GLN99D, GLU102C, GLU102D, GLU105C, GLU105D, GLU17C, GLU17D, GLU94C, GLU94D, GLY104C, GLY104D, GLY24C, GLY24D, GLY25C, GLY25D, GLY29C, GLY29D, GLY68C, GLY68D, GLY90C, GLY90D, HIS34C, HIS34D, ILE23C, ILE23D, ILE30C, ILE30D, ILE36C, ILE36D, ILE48C, ILE48D, ILE52C, ILE52D, ILE69C, ILE69D, ILE96C, ILE96D, LEU20C, LEU20D, LEU31C, LEU31D, LEU93C, LEU93D, LEU98C, LEU98D, LYS101C, LYS101D, LYS26C, LYS26D, LYS28C, LYS28D, MET100C, MET100D, PHE18C, PHE18D, PHE32C, PHE32D, PHE89C, PHE89D, PRO15C, PRO15D, PRO50C, PRO50D, PRO95C, PRO95D, SER106C, SER106D, SER51C, SER51D, THR19C, THR19D, THR92C, THR92D, TRP103C, TRP103D, TRP27C, TRP27D, TYR33C, TYR33D, VAL110D, VAL16C, VAL16D, VAL22C, VAL22D, VAL97C, VAL97D
• C-E: ASP109C, PRO79E, VAL78E
• D-E: ALA66D, ARG62D, ARG72D, ASP67D, GLN77E, GLU63D, GLU65D, GLU73D, GLU73E, GLU83E, GLU88D, GLY68D, GLY90D, HIS71D, HIS71E, HIS76D, HIS76E, ILE69D, LEU61D, LEU64D, LYS39E, LYS81E, PHE89D, PRO79E, PRO80E, SER85D, THR87D, TYR75E, TYR84D, VAL70D, VAL74D, VAL74E, VAL78E
• D-H: HIS76D, HIS76H
• E-F: ARG108E, ARG108F, ARG47F, ARG91E, ARG91F, ASN107E, ASN107F, ASP109E, ASP109F, ASP21E, ASP21F, ASP67E, ASP67F, CYS14E, CYS14F, CYS49E, CYS49F, GLN99E, GLN99F, GLU102E, GLU102F, GLU105E, GLU105F, GLU17E, GLU17F, GLU94E, GLU94F, GLY104E, GLY104F, GLY24E, GLY24F, GLY25E, GLY25F, GLY29E, GLY29F, GLY90E, GLY90F, HIS34E, HIS34F, ILE23E, ILE23F, ILE30E, ILE30F, ILE36E, ILE36F, ILE48E, ILE48F, ILE52F, ILE69E, ILE69F, ILE96E, ILE96F, LEU20E, LEU20F, LEU31E, LEU31F, LEU93E, LEU93F, LEU98E, LEU98F, LYS101E, LYS101F, LYS26E, LYS26F, LYS28E, LYS28F, MET100E, MET100F, PHE18E, PHE18F, PHE32E, PHE32F, PHE89E, PHE89F, PRO15E, PRO15F, PRO50E, PRO50F, PRO95E, PRO95F, SER106E, SER106F, SER51E, SER51F, THR19E, THR19F, THR92E, THR92F, TRP103E, TRP103F, TRP27E, TRP27F, TYR33E, TYR33F, VAL110F, VAL16E, VAL16F, VAL22E, VAL22F, VAL97E, VAL97F
• E-H: ALA66E, ARG55H, ARG62H, ARG72H, ASP21E, ASP67E, CYS14E, GLN54H, GLU17E, GLU63E, GLU63H, GLU65H, GLY68E, HIS71E, HIS76H, ILE23E, LEU20E, LEU57H, LEU59H, LYS28E, MET56H, PHE18E, PHE42H, PHE89E, PRO15E, PRO80H, THR19E, THR53H, THR58H, VAL16E, VAL22E, VAL74H
• F-G: ARG46F, ARG55F, GLN54F, ILE52G, LYS26G, MET56G, PRO50G, SER51G, THR53F, THR53G, TRP27G
• F-H: ALA66H, ARG108F, ARG41H, ARG46H, ARG47F, ARG55H, ARG62H, ARG72H, ASN43H, ASP109F, CYS49F, GLN54H, GLN60H, GLU105F, GLU63H, GLU65H, HIS34F, ILE30F, ILE48F, ILE52F, LEU57H, LEU59H, LEU61H, LYS101F, LYS26F, LYS26H, LYS28H, LYS81H, MET56H, PHE42H, PHE45H, PRO50F, PRO79H, PRO80H, SER51F, THR53H, THR58H, TRP103F, TRP27F, TYR33F, TYR84H, VAL110F, VAL74H, VAL82H
• G-H: ALA66G, ARG108G, ARG108H, ARG91G, ARG91H, ASN107G, ASN107H, ASP109G, ASP109H, ASP21G, ASP21H, ASP67G, ASP67H, CYS14G, CYS14H, CYS49G, CYS49H, GLN99G, GLN99H, GLU102G, GLU102H, GLU105G, GLU105H, GLU17G, GLU17H, GLU94G, GLU94H, GLY104G, GLY104H, GLY24G, GLY24H, GLY25G, GLY25H, GLY29G, GLY29H, GLY68G, GLY68H, GLY90G, GLY90H, HIS34G, HIS34H, ILE23G, ILE23H, ILE30G, ILE30H, ILE36G, ILE36H, ILE48G, ILE48H, ILE52G, ILE52H, ILE69G, ILE69H, ILE96G, ILE96H, LEU20G, LEU20H, LEU31G, LEU31H, LEU93G, LEU93H, LEU98G, LEU98H, LYS101G, LYS101H, LYS26G, LYS26H, LYS28G, LYS28H, MET100G, MET100H, PHE18G, PHE18H, PHE32G, PHE32H, PHE89G, PHE89H, PRO15G, PRO15H, PRO50G, PRO50H, PRO95G, PRO95H, SER106G, SER106H, SER51G, SER51H, THR19G, THR19H, THR92G, THR92H, TRP103G, TRP103H, TRP27G, TRP27H, TYR33G, TYR33H, VAL110H, VAL16G, VAL16H, VAL22G, VAL22H, VAL97G, VAL97H