2C7I

structure of protein ta0514, putative lipoate protein ligase from t. acidophilum.

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 83
  • Norm. En. per Res.: -2.2515
• 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	-9.4799	-43.5285	-78.0303	-131.0387	59	4	1	3546	3	39	35
A-D	-17.0604	-22.717	-139.436	-179.2134	86	8	1	5637	1	32	38
C-D	-18.8441	-27.8707	-140.161	-186.8758	83	13	2	5259	2	30	36

Interface residues

• A-B: ARG211A, ARG211B, ARG240A, ARG40A, ARG40B, ARG43A, ARG43B, ASN13A, ASN13B, ASN65B, ASP169B, ASP208B, ASP229A, ASP42A, ASP42B, ASP60B, ASP82B, GLU228A, GLU233A, GLU236A, GLU9A, GLU9B, GLY12A, GLY12B, GLY66A, GLY66B, GLY84B, HIS167A, HIS167B, HIS41A, HIS41B, ILE207B, ILE231A, ILE67B, LEU6A, LEU7A, LEU83A, LEU83B, LEU8A, LYS63B, LYS64B, MET16A, MET172B, MET68A, MET68B, PHE243A, PHE38A, PRO11A, PRO11B, THR10A, THR10B, THR14A, THR168B, THR230A, THR232A, TYR20A, TYR39A, TYR61B, TYR80B
• A-D: ALA121D, ALA141D, ALA150A, ALA152A, ALA197D, ALA53A, ARG104D, ARG115D, ARG122D, ARG154A, ARG195D, ARG258A, ARG26A, ARG71A, ARG72A, ASN112D, ASN127A, ASN127D, ASN134D, ASN198D, ASN253A, ASP120D, ASP128A, ASP128D, ASP138D, ASP201D, ASP96A, ASP98A, GLN51A, GLU108D, GLU125D, GLU143D, GLU194D, GLU22A, GLU251A, GLU54A, GLU55A, GLU56A, GLY124D, GLY142D, GLY151A, GLY255A, GLY48A, GLY75A, GLY76A, GLY77A, HIS161A, ILE139D, ILE146D, ILE47A, ILE99A, LEU119D, LEU126D, LEU159A, LEU170D, LEU242A, LEU256A, LEU257A, LYS135D, LYS136D, LYS144D, LYS145D, LYS155A, LYS246A, MET140D, MET153A, MET254A, MET97A, PHE202D, PHE50A, PRO123D, SER101D, SER130A, THR105D, THR200D, THR221D, THR74A, TRP252A, TYR25A, TYR49A, TYR73A, VAL111D, VAL129A, VAL133D, VAL196D, VAL52A
• C-D: ALA121C, ALA141C, ALA150D, ALA152D, ALA197C, ALA53D, ARG104C, ARG115C, ARG122C, ARG154D, ARG195C, ARG26D, ARG71D, ARG72D, ASN112C, ASN127C, ASN127D, ASN134C, ASN198C, ASN253D, ASP120C, ASP128D, ASP138C, ASP201C, GLN51D, GLU108C, GLU125C, GLU143C, GLU194C, GLU22D, GLU251D, GLU54D, GLU55D, GLU56D, GLY124C, GLY142C, GLY151D, GLY255D, GLY48D, GLY75D, GLY76D, HIS161D, ILE139C, ILE146C, ILE47D, ILE99D, LEU119C, LEU126C, LEU159D, LEU170C, LEU242D, LEU256D, LEU257D, LYS136C, LYS144C, LYS145C, LYS155D, LYS246D, MET140C, MET153D, MET254D, MET97D, PHE202C, PHE50D, PRO123C, SER101C, SER130D, THR100C, THR100D, THR200C, THR74D, TRP252D, TYR247D, TYR25D, TYR49D, TYR73D, VAL111C, VAL129D, VAL133C, VAL196C, VAL199C, VAL203C, VAL52D