2L9H

oligomeric structure of the chemokine ccl5/rantes from nmr, ms, and saxs data

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 67
  • Norm. En. per Res.: -6.193
• Hub Node: A(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	-107.8875	-44.9905	-262.266	-415.144	69	16	2	8448	2	9	1
A-C	-39.7982	16.2584	-169.409	-192.9488	86	71	7	9703	1	16	14
A-D	0.0	0.0	-0.2139	-0.2139	4	0	0	47	0	0	1
B-C	0.0	0.0	-0.0269	-0.0269	4	0	0	13	0	0	1
C-D	-113.4568	-46.4966	-254.978	-414.9314	67	16	2	8318	2	9	2

Interface residues

• A-B: ALA13A, ALA13B, ALA16B, ALA38A, ALA38B, ALA51A, ALA51B, ARG47A, ARG47B, ASN36A, ASN36B, ASN46A, ASN46B, ASP6A, ASP6B, CYS10A, CYS10B, CYS11A, CYS11B, CYS34A, CYS34B, CYS50A, CYS50B, GLN48A, GLN48B, GLY32A, GLY32B, ILE15A, ILE15B, LEU19B, LYS33A, LYS33B, LYS45A, PHE12A, PHE12B, PHE28A, PHE28B, PHE41A, PHE41B, PRO2A, PRO9A, PRO9B, SER31A, SER31B, SER35A, SER35B, SER4A, SER4B, SER5A, SER5B, THR30A, THR30B, THR43A, THR43B, THR7A, THR7B, THR8A, THR8B, TYR14A, TYR14B, TYR3A, VAL39A, VAL39B, VAL40A, VAL40B, VAL42A, VAL42B, VAL49A, VAL49B
• A-C: ALA38A, ALA38C, ALA51C, ARG21A, ARG44A, ARG44C, ARG47A, ARG47C, ARG59A, ARG59C, ASN46A, ASN46C, ASN63A, ASN63C, ASP6A, ASP6C, CYS11C, CYS34A, CYS34C, CYS50C, GLN48A, GLN48C, GLU26A, GLU26C, GLU60A, GLU60C, GLU66A, GLU66C, GLY32A, GLY32C, ILE24A, ILE24C, ILE62A, ILE62C, LEU65A, LEU65C, LYS25A, LYS25C, LYS33A, LYS33C, LYS56A, LYS56C, MET67A, MET67C, PHE28A, PHE28C, PHE41A, PHE41C, PRO2A, PRO2C, PRO53C, PRO9A, PRO9C, SER31A, SER31C, SER4A, SER4C, SER64A, SER64C, SER68A, SER68C, THR30A, THR30C, THR43A, THR7A, THR7C, THR8A, THR8C, TYR27A, TYR27C, TYR29A, TYR29C, TYR3A, TYR3C, TYR61A, TYR61C, VAL39A, VAL39C, VAL40A, VAL40C, VAL42A, VAL42C, VAL49A, VAL49C, VAL58A, VAL58C
• A-D: GLU66A, MET67A, SER5D, THR7D
• B-C: GLN48B, GLU66C, MET67C, THR7B
• C-D: ALA13C, ALA13D, ALA16D, ALA38C, ALA38D, ALA51C, ALA51D, ARG47C, ARG47D, ASN36C, ASN36D, ASN46C, ASN46D, ASP6C, ASP6D, CYS10C, CYS10D, CYS11C, CYS11D, CYS34C, CYS34D, CYS50C, CYS50D, GLN48C, GLN48D, GLY32C, GLY32D, ILE15C, ILE15D, LEU19D, LYS33C, LYS33D, LYS45C, PHE12C, PHE12D, PHE28D, PHE41C, PHE41D, PRO2C, PRO9C, PRO9D, SER31C, SER31D, SER35C, SER35D, SER4C, SER4D, SER5C, SER5D, THR30C, THR30D, THR43C, THR7C, THR7D, THR8C, THR8D, TYR14C, TYR14D, TYR3C, VAL39C, VAL39D, VAL40C, VAL40D, VAL42C, VAL42D, VAL49C, VAL49D