3BB5

crystal structure of a dimeric ferredoxin-like protein of unknown function (jann_3925) from jannaschia sp. ccs1 at 2.30 a resolution

• Total interactions analyzed: 15
• Total true interactions: 10
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 112
  • Norm. En. per Res.: -5.2952
• 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	-118.8818	-29.6234	-375.84	-524.3452	107	20	5	15027	3	39	33
A-C	0.0	0.0	-0.3556	-0.3556	8	0	0	92	0	1	3
A-D	0.0	0.0	-0.0006	-0.0006	2	0	0	2	0	0	1
A-E	-2.2785	-9.6181	-71.8132	-83.7097	42	3	1	3029	1	19	13
A-F	0.0	0.0	-0.764	-0.764	8	0	0	119	0	6	5
C-D	-130.7005	-31.418	-430.94	-593.0586	112	20	5	16615	2	39	32
C-E	-11.7616	-10.2357	-177.776	-199.7733	70	10	1	6864	0	17	32
C-F	0.0	0.0	-0.0231	-0.0231	3	0	0	7	0	1	0
D-E	0.0	0.0	-0.0157	-0.0157	2	0	0	4	0	1	0
E-F	-111.0277	-35.0402	-398.325	-544.3929	106	18	5	15382	2	39	34

Interface residues

• A-B: ALA72A, ALA72B, ALA92A, ALA92B, ARG40A, ARG40B, ARG45A, ARG45B, ARG53A, ARG53B, ASN44A, ASN44B, ASN90A, ASN90B, ASP46A, ASP46B, ASP64A, ASP64B, ASP69A, ASP69B, ASP93A, ASP93B, ASP99A, ASP99B, CYS60A, CYS60B, GLN49A, GLN49B, GLN78B, GLU101A, GLU101B, GLU38A, GLU38B, GLU48A, GLU48B, GLU52A, GLU52B, GLY0A, GLY0B, GLY42A, GLY42B, GLY57A, GLY57B, GLY91A, GLY91B, GLY94A, GLY94B, HIS41A, HIS41B, HIS4A, HIS4B, HIS77A, HIS77B, ILE95A, ILE95B, LEU100A, LEU100B, LEU2A, LEU2B, LEU59A, LEU59B, LEU5A, LEU5B, LEU68A, LEU68B, LEU8A, LEU8B, LEU96A, LEU96B, LYS50A, LYS50B, LYS65A, LYS65B, PHE39A, PHE39B, PHE47A, PHE47B, PHE58A, PHE58B, PHE62A, PHE62B, PRO43A, PRO43B, PRO55A, PRO55B, SER51A, SER51B, THR61A, THR61B, TYR3A, TYR3B, TYR54A, TYR54B, TYR56A, TYR56B, TYR71A, TYR71B, VAL102A, VAL102B, VAL6A, VAL6B, VAL85A, VAL85B, VAL97A, VAL97B, VAL98A, VAL98B
• A-C: ALA92C, ARG40A, ASN90C, ASP93C, GLU32A, GLY91C, PRO31A, VAL85C
• A-D: GLN49D, PRO34A
• A-E: ALA22E, ALA24A, ALA24E, ALA30A, ALA30E, ALA80A, ARG18A, ARG18E, ARG40E, ARG45E, ARG79A, ARG79E, ASP17A, ASP17E, ASP27A, ASP27E, GLU21A, GLU21E, GLU32A, GLU32E, GLY28A, GLY28E, GLY42E, HIS41E, HIS74A, HIS77A, ILE19E, ILE25A, ILE25E, LEU26A, LEU26E, LEU29A, LEU29E, LEU33A, PHE39E, PRO31A, PRO31E, PRO43E, PRO75A, THR76A, THR76E, TYR56E
• A-F: ARG18A, ARG79A, ASP17A, GLU101F, GLU21A, GLY0F, ILE25A, VAL102F
• C-D: ALA72C, ALA72D, ALA92C, ALA92D, ARG40C, ARG40D, ARG45C, ARG45D, ARG53C, ARG53D, ASN-5D, ASN44C, ASN44D, ASN90C, ASN90D, ASP46C, ASP46D, ASP64C, ASP64D, ASP69C, ASP69D, ASP93C, ASP93D, ASP99C, ASP99D, CYS60C, CYS60D, GLN-1D, GLN49C, GLN49D, GLU101C, GLU101D, GLU38C, GLU38D, GLU48C, GLU48D, GLU52C, GLU52D, GLY0C, GLY0D, GLY42C, GLY42D, GLY57C, GLY57D, GLY91C, GLY91D, GLY94C, GLY94D, HIS41C, HIS41D, HIS4C, HIS4D, HIS77C, HIS77D, ILE95C, ILE95D, LEU-4D, LEU100C, LEU100D, LEU2C, LEU2D, LEU59C, LEU59D, LEU5C, LEU5D, LEU68C, LEU68D, LEU8C, LEU8D, LEU96C, LEU96D, LYS50C, LYS50D, LYS65C, LYS65D, PHE-2D, PHE39C, PHE39D, PHE47C, PHE47D, PHE58C, PHE58D, PHE62C, PHE62D, PRO43C, PRO43D, PRO55C, PRO55D, SER51C, SER51D, THR37D, THR61C, THR61D, TYR-3D, TYR3C, TYR3D, TYR54C, TYR54D, TYR56C, TYR56D, TYR71C, TYR71D, VAL102C, VAL102D, VAL6C, VAL6D, VAL85C, VAL85D, VAL97C, VAL97D, VAL98C, VAL98D
• C-E: ALA15C, ALA15E, ALA22C, ALA22E, ALA72C, ALA72E, ALA80C, ALA80E, ALA86C, ALA86E, ALA92C, ALA92E, ARG18C, ARG18E, ARG79C, ARG79E, ARG89C, ARG89E, ASN90C, ASN90E, ASP17C, ASP17E, ASP93C, ASP93E, CYS88C, CYS88E, GLN78C, GLN78E, GLU11C, GLU11E, GLU13C, GLU13E, GLU21C, GLU21E, GLY12C, GLY12E, GLY14C, GLY14E, GLY81C, GLY81E, GLY82C, GLY82E, GLY91C, GLY91E, GLY94C, GLY94E, HIS74C, HIS74E, HIS77C, HIS77E, ILE19C, ILE19E, ILE25C, ILE25E, ILE95C, ILE95E, LEU84C, LEU84E, PRO75C, PRO75E, SER87C, SER87E, THR76C, THR76E, TYR71C, TYR71E, VAL73C, VAL73E, VAL85C, VAL85E
• C-F: ARG79C, GLU48F, LYS50F
• D-E: ARG79E, GLU48D
• E-F: ALA72E, ALA72F, ALA92E, ALA92F, ARG40E, ARG40F, ARG45E, ARG45F, ARG53E, ARG53F, ASN44E, ASN44F, ASN90E, ASN90F, ASP46E, ASP46F, ASP64E, ASP64F, ASP69E, ASP69F, ASP93E, ASP93F, ASP99E, ASP99F, CYS60E, GLN-1E, GLN49E, GLN49F, GLU101E, GLU101F, GLU38E, GLU38F, GLU48E, GLU48F, GLU52E, GLU52F, GLY0E, GLY0F, GLY42E, GLY42F, GLY57E, GLY57F, GLY91E, GLY91F, GLY94E, GLY94F, HIS41E, HIS41F, HIS4E, HIS4F, HIS77E, HIS77F, ILE95E, ILE95F, LEU100E, LEU100F, LEU2E, LEU2F, LEU59E, LEU59F, LEU5E, LEU5F, LEU68E, LEU68F, LEU8E, LEU8F, LEU96E, LEU96F, LYS50E, LYS50F, LYS65E, LYS65F, PHE39E, PHE39F, PHE47E, PHE47F, PHE58E, PHE58F, PHE62E, PHE62F, PRO43E, PRO43F, PRO55E, PRO55F, SER51E, SER51F, THR61E, THR61F, TYR3E, TYR3F, TYR54E, TYR54F, TYR56E, TYR56F, TYR71E, TYR71F, VAL102E, VAL102F, VAL6E, VAL6F, VAL85E, VAL85F, VAL97E, VAL97F, VAL98E, VAL98F