3KYE

crystal structure of roadblock/lc7 domain from streptomyces avermitilis

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 106
  • Norm. En. per Res.: -4.1118
• 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	-105.5264	45.8653	-376.187	-435.8481	106	16	23	15142	0	20	15
A-C	-9.8374	-3.8689	-58.6001	-72.3064	35	1	1	2497	1	3	7
B-C	-17.6775	26.4548	-124.082	-115.3047	59	10	0	4821	4	9	12
B-D	0.0	0.0	-2.2182	-2.2182	5	0	0	49	0	1	3
C-D	-105.7748	30.4386	-352.286	-427.6222	105	16	23	14733	3	22	17

Interface residues

• A-B: ALA50A, ALA50B, ALA54A, ALA54B, ALA55A, ALA55B, ALA57A, ALA57B, ALA67A, ALA67B, ARG106A, ARG106B, ARG65A, ARG65B, ARG70A, ARG70B, ARG78A, ARG78B, ASP46A, ASP46B, ASP48A, ASP48B, ASP51A, ASP51B, ASP73A, ASP73B, ASP76A, ASP76B, ASP85A, ASP85B, GLN79A, GLN79B, GLU83A, GLU83B, GLY44B, GLY59A, GLY59B, GLY64A, GLY64B, GLY68A, GLY68B, GLY72A, GLY72B, GLY74A, GLY74B, GLY75A, GLY75B, HIS52A, HIS52B, ILE69A, ILE69B, LEU103A, LEU103B, LEU45A, LEU45B, LEU56A, LEU56B, LEU60A, LEU60B, LEU63A, LEU63B, LEU84A, LEU84B, LEU88A, LEU88B, LEU89A, LEU89B, PHE71A, PHE71B, PHE7B, PHE90A, PHE90B, PRO47A, PRO47B, SER29A, SER29B, SER49A, SER49B, SER58A, SER58B, SER62A, SER62B, SER66A, SER66B, SER86A, SER86B, SER92A, THR28A, THR28B, THR87A, THR87B, THR93A, TYR61A, TYR61B, VAL31A, VAL31B, VAL77A, VAL77B, VAL80A, VAL80B, VAL81A, VAL81B, VAL82A, VAL82B, VAL91A, VAL91B
• A-C: ALA54A, ALA55A, ALA57A, ARG125C, ASP12C, ASP14C, ASP36A, ASP48A, ASP51A, CYS35A, GLY37A, GLY59A, HIS52A, LEU128C, LEU13C, LEU16C, LEU38A, LEU56A, LEU60A, LEU63A, LYS122C, PRO126C, SER11C, SER123C, SER34A, SER49A, SER58A, SER62A, SER66A, THR130C, TRP15C, TYR127C, TYR61A, VAL124C, VAL39A
• B-C: ALA111C, ALA118C, ALA54B, ALA55B, ALA57B, ALA67B, ARG125C, ARG23C, ARG65B, ARG70B, ARG78C, ASP12C, ASP14C, ASP36B, ASP76B, CYS35B, GLN22C, GLN79C, GLU116C, GLY114C, GLY19C, GLY37B, GLY59B, GLY64B, GLY68B, GLY74B, GLY95B, GLY97B, ILE69B, LEU120C, LEU13C, LEU16C, LEU20C, LEU33B, LEU38B, LEU56B, LEU60B, LEU63B, LYS122C, LYS40B, PHE71B, PRO126C, SER123C, SER18C, SER34B, SER58B, SER62B, SER66B, SER96B, THR98B, TRP15C, TYR115C, TYR127C, TYR1B, TYR61B, VAL112C, VAL121C, VAL124C, VAL24C
• B-D: ARG106D, GLU83D, LEU38B, LEU88D, TYR1B
• C-D: ALA104C, ALA50C, ALA50D, ALA54C, ALA54D, ALA55C, ALA55D, ALA57C, ALA57D, ALA67C, ALA67D, ARG106C, ARG106D, ARG65C, ARG65D, ARG70C, ARG70D, ARG78C, ARG78D, ASP46C, ASP46D, ASP48C, ASP48D, ASP51C, ASP51D, ASP73C, ASP73D, ASP76C, ASP76D, ASP85C, ASP85D, GLN79C, GLN79D, GLU83C, GLU83D, GLY44D, GLY59C, GLY59D, GLY64C, GLY64D, GLY68C, GLY68D, GLY72C, GLY72D, GLY74C, GLY74D, GLY75C, GLY75D, HIS52C, HIS52D, ILE69C, ILE69D, LEU103C, LEU103D, LEU45C, LEU45D, LEU56C, LEU56D, LEU60C, LEU60D, LEU63C, LEU63D, LEU84C, LEU84D, LEU88C, LEU88D, LEU89C, LEU89D, PHE71C, PHE71D, PHE90C, PHE90D, PRO47D, SER29C, SER29D, SER49C, SER49D, SER58C, SER58D, SER62C, SER62D, SER66C, SER66D, SER86C, SER86D, SER92D, THR28C, THR28D, THR87C, THR87D, THR93C, TYR61C, TYR61D, VAL31C, VAL31D, VAL77C, VAL77D, VAL80C, VAL80D, VAL81C, VAL81D, VAL82C, VAL82D, VAL91C, VAL91D