2ZOP

x-ray crystal structure of a crispr-associated cmr5 family protein from thermus thermophilus hb8

• Total interactions analyzed: 15
• Total true interactions: 9
• Strongest Interaction:
  • Chains: C-F
  • Int. Res.: 35
  • Norm. En. per Res.: -5.9143
• Hub Node: B(3)

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	0.0	0.0	-41.1417	-41.1417	26	0	3	2404	0	4	5
A-C	0.0	0.0	-48.49	-48.49	30	1	3	2625	0	4	6
B-C	0.0	0.0	-56.8733	-56.8733	31	4	5	2953	3	5	7
B-E	0.0	-21.6791	-45.1238	-66.8029	31	3	0	1870	1	29	30
B-F	0.0	0.0	-0.0306	-0.0306	3	0	0	9	0	1	1
C-F	-42.2486	-83.7619	-80.9907	-207.0012	35	2	0	2542	10	25	34
D-E	0.0	0.0	-41.7791	-41.7791	33	2	3	2523	0	4	6
D-F	0.0	0.0	-52.1074	-52.1074	32	7	3	2846	0	5	7
E-F	0.0	-17.4924	-56.428	-73.9204	33	2	4	2871	0	5	7

Interface residues

• A-B: ALA42A, ALA47A, ALA49A, ARG54A, ARG92B, ARG95B, GLN41A, GLN46A, GLN89B, GLU86B, GLY43A, LEU35A, LEU38A, LEU48A, LEU87B, LEU88B, LEU91B, LYS34A, PHE50A, SER45A, SER53A, THR94B, TYR90B, VAL37A, VAL39A, VAL51A
• A-C: ALA42C, ALA47C, ALA49C, ARG40A, ARG40C, ARG92A, ARG95A, ASP30C, GLN41C, GLN46C, GLN89A, GLU86A, GLY43C, LEU35C, LEU38C, LEU48C, LEU87A, LEU88A, LEU91A, LEU98A, LYS34C, LYS56C, PHE50C, SER45C, SER53C, THR94A, TYR90A, VAL37C, VAL39C, VAL51C
• B-C: ALA42B, ALA47B, ALA49B, ARG40B, ARG54B, ARG92C, ARG95C, ASP30B, GLN41B, GLN46B, GLN89C, GLU86C, GLY43B, LEU33B, LEU35B, LEU38B, LEU44B, LEU48B, LEU87C, LEU88C, LEU91C, LEU98C, LYS34B, PHE50B, SER45B, SER53B, THR94C, TYR90C, VAL37B, VAL39B, VAL51B
• B-E: ALA49B, ALA49E, ALA58B, ALA58E, ALA61B, ARG54B, ARG54E, ARG73E, ARG76B, ARG76E, ARG83E, ASP52B, ASP52E, ASP74B, GLU27E, GLU57B, GLU57E, GLU80E, GLY55B, GLY55E, HIS59B, HIS59E, LEU75E, LYS56B, LYS60B, LYS60E, PHE50B, SER53B, SER53E, VAL51B, VAL51E
• B-F: ARG54B, GLU86F, SER53B
• C-F: ALA79C, ALA79F, ALA81C, ALA81F, ALA82C, ALA82F, ALA85C, ALA85F, ARG73C, ARG73F, ARG76C, ARG76F, ARG83C, ARG83F, ASN64F, ASP52C, ASP52F, ASP74C, ASP74F, GLU77C, GLU77F, GLU80C, GLU80F, GLU84C, GLU84F, GLU86C, GLU86F, LEU75F, LEU78C, LEU78F, LYS60C, LYS60F, SER53F, TYR72C, TYR72F
• D-E: ALA42D, ALA47D, ALA49D, ARG40D, ARG40E, ARG54D, ARG92E, ARG95E, ASP30D, GLN41D, GLN46D, GLN89E, GLU86E, GLY43D, GLY43E, LEU35D, LEU38D, LEU44E, LEU48D, LEU87E, LEU88E, LEU91E, LEU98E, LYS34D, PHE50D, SER45D, SER53D, THR94E, TYR90E, VAL37D, VAL39D, VAL39E, VAL51D
• D-F: ALA42F, ALA47F, ALA49F, ARG40D, ARG40F, ARG54F, ARG92D, ARG95D, ASP30F, GLN41F, GLN46F, GLN89D, GLU86D, GLY43D, GLY43F, HIS59F, LEU35F, LEU38F, LEU48F, LEU87D, LEU88D, LEU91D, LEU98D, LYS34F, PHE50F, SER45F, SER53F, THR94D, TYR90D, VAL37F, VAL39F, VAL51F
• E-F: ALA42E, ALA47E, ALA49E, ARG40E, ARG40F, ARG54E, ARG92F, ARG95F, ASP30E, GLN41E, GLN46E, GLN89F, GLU86F, GLY43E, GLY43F, GLY55E, HIS59E, LEU35E, LEU38E, LEU48E, LEU87F, LEU88F, LEU91F, LEU98F, LYS34E, PHE50E, SER45E, SER53E, THR94F, TYR90F, VAL37E, VAL39E, VAL51E