3AAI

x-ray crystal structure of csor from thermus thermophilus hb8

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 139
  • Norm. En. per Res.: -4.5099
• 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	-65.7604	-62.3612	-498.748	-626.8696	139	30	38	23524	5	85	61
A-D	-19.9907	-34.0174	-103.583	-157.5911	42	4	7	5034	4	32	24
B-C	0.0	-8.9334	-95.3037	-104.2371	38	4	8	4836	0	27	20
C-D	-61.2885	-55.894	-511.601	-628.7835	140	32	38	23205	5	87	61

Interface residues

• A-B: ALA16A, ALA16B, ALA23A, ALA23B, ALA50A, ALA50B, ALA54A, ALA54B, ALA65A, ALA65B, ALA90A, ALA90B, ARG13A, ARG13B, ARG17A, ARG17B, ARG18A, ARG18B, ARG19A, ARG19B, ARG32A, ARG32B, ARG57A, ARG57B, ARG64A, ARG64B, ASP36A, ASP36B, ASP43A, ASP43B, ASP56A, ASP56B, ASP69A, ASP69B, ASP9A, ASP9B, CYS41A, CYS41B, GLN47A, GLN47B, GLU14A, GLU14B, GLU15A, GLU15B, GLU28A, GLU28B, GLU35A, GLU35B, GLU37A, GLU37B, GLU52A, GLU52B, GLU60A, GLU60B, GLU82A, GLU85A, GLU85B, GLU86A, GLU86B, GLU89A, GLU89B, GLY25A, GLY25B, GLY29A, GLY29B, GLY53A, GLY53B, GLY59A, GLY59B, HIS26A, HIS26B, HIS5B, HIS66A, HIS66B, HIS70A, HIS70B, HIS7A, HIS7B, ILE30A, ILE30B, ILE83A, ILE83B, LEU20A, LEU20B, LEU21A, LEU21B, LEU27A, LEU27B, LEU31A, LEU31B, LEU34A, LEU34B, LEU45A, LEU45B, LEU48A, LEU48B, LEU55A, LEU55B, LEU63A, LEU63B, LEU67A, LEU67B, LEU6B, LEU87A, LEU87B, LEU8A, LEU8B, LEU91A, LEU91B, LYS24A, LYS24B, LYS38A, LYS38B, LYS46A, LYS46B, LYS49A, LYS49B, LYS92A, PRO10A, PRO10B, SER22A, SER22B, TYR40A, TYR40B, VAL12A, VAL12B, VAL39A, VAL39B, VAL42A, VAL42B, VAL44A, VAL44B, VAL51A, VAL51B, VAL58A, VAL58B, VAL62A, VAL62B, VAL84A
• A-D: ALA65A, ALA65D, ARG57A, ARG64A, ARG64D, ASP56A, ASP56D, ASP69A, ASP69D, ASP79A, GLU60A, GLU60D, GLU81A, GLU82A, GLU85A, GLU85D, GLU86A, GLU86D, GLU89A, GLU89D, HIS66A, HIS66D, HIS70A, HIS70D, ILE83A, ILE83D, LEU63A, LEU63D, LEU67A, LEU67D, LEU87A, LEU87D, LEU91A, LEU91D, LYS68A, LYS68D, LYS92A, LYS92D, VAL71D, VAL80A, VAL84A, VAL84D
• B-C: ALA65B, ALA65C, ALA72B, ARG64B, ARG64C, ASP69B, ASP69C, GLU60B, GLU60C, GLU81C, GLU82C, GLU85B, GLU85C, GLU86B, GLU86C, GLU89B, GLU89C, HIS66B, HIS66C, HIS70B, HIS70C, ILE83B, ILE83C, LEU63B, LEU63C, LEU67B, LEU67C, LEU87B, LEU87C, LEU91B, LEU91C, LYS68B, LYS68C, LYS92C, VAL71B, VAL80C, VAL84B, VAL84C
• C-D: ALA16C, ALA16D, ALA23C, ALA23D, ALA50C, ALA50D, ALA54C, ALA54D, ALA65C, ALA65D, ALA90C, ALA90D, ARG13C, ARG13D, ARG17C, ARG17D, ARG18C, ARG18D, ARG19C, ARG19D, ARG32C, ARG32D, ARG57C, ARG57D, ARG64C, ARG64D, ASP36C, ASP36D, ASP43C, ASP43D, ASP56C, ASP56D, ASP69C, ASP69D, ASP9C, ASP9D, CYS41C, CYS41D, GLN47C, GLN47D, GLU14C, GLU14D, GLU15C, GLU15D, GLU28C, GLU28D, GLU35C, GLU35D, GLU37C, GLU37D, GLU52C, GLU52D, GLU60C, GLU60D, GLU82C, GLU85C, GLU85D, GLU86C, GLU86D, GLU89C, GLU89D, GLY25C, GLY25D, GLY29C, GLY29D, GLY53C, GLY53D, GLY59C, GLY59D, HIS26C, HIS26D, HIS5D, HIS66C, HIS66D, HIS70C, HIS70D, HIS7C, HIS7D, ILE30C, ILE30D, ILE83C, ILE83D, LEU20C, LEU20D, LEU21C, LEU21D, LEU27C, LEU27D, LEU31C, LEU31D, LEU34C, LEU34D, LEU45C, LEU45D, LEU48C, LEU48D, LEU55C, LEU55D, LEU63C, LEU63D, LEU67C, LEU67D, LEU6D, LEU87C, LEU87D, LEU8C, LEU8D, LEU91C, LEU91D, LYS24C, LYS24D, LYS38C, LYS38D, LYS46C, LYS46D, LYS49C, LYS49D, LYS92C, LYS92D, PRO10C, PRO10D, SER22C, SER22D, TYR40C, TYR40D, VAL12C, VAL12D, VAL39C, VAL39D, VAL42C, VAL42D, VAL44C, VAL44D, VAL51C, VAL51D, VAL58C, VAL58D, VAL62C, VAL62D, VAL84C