3OGF

crystal structure of difoil-4p homo-trimer: de novo designed dimeric trefoil-fold sub-domain which forms homo-trimer assembly

• Total interactions analyzed: 3
• Total true interactions: 2
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 96
  • Norm. En. per Res.: -4.7662
• Hub Node: A(1)

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	-122.2256	17.8521	-353.18	-457.5535	96	20	10	15345	1	27	30
B-C	-87.1713	-2.7327	-346.534	-436.438	93	17	11	15011	0	25	27

Interface residues

• A-B: ARG24A, ARG35A, ARG35B, ARG37A, ARG37B, ARG66A, ARG66B, ARG76B, ARG78B, ASN51A, ASN51B, ASN68A, ASN68B, ASP32A, ASP36B, ASP39B, ASP70A, ASP70B, ASP74A, ASP74B, ASP80A, GLN21A, GLN43A, GLN43B, GLN45B, GLN63B, GLN84A, GLN86A, GLU18A, GLU49A, GLU49B, GLU53A, GLU53B, GLU60B, GLU90A, GLY20A, GLY33A, GLY52A, GLY52B, GLY62B, GLY71A, GLY71B, GLY75B, HIS41B, HIS82A, HIS82B, ILE25A, ILE42B, ILE46A, ILE46B, ILE67A, ILE67B, ILE83A, ILE87A, LEU13A, LEU14A, LEU23A, LEU55B, LEU56A, LEU56B, LEU65A, LEU65B, LYS15A, LYS57B, PHE44A, PHE44B, PHE85A, PRO11A, PRO40B, PRO48B, PRO69A, PRO69B, PRO81A, PRO89A, SER16A, SER38B, SER47B, SER58B, SER88A, THR17A, THR19A, THR30A, THR34A, THR59B, THR61B, THR72A, THR72B, THR76B, TYR22A, TYR64B, VAL12A, VAL31A, VAL54A, VAL54B, VAL73A, VAL73B
• B-C: ARG24B, ARG24C, ARG35B, ARG35C, ARG37B, ARG37C, ARG66C, ARG78B, ASN26B, ASN51C, ASN68C, ASP28B, ASP32B, ASP32C, ASP70C, ASP74C, ASP77B, ASP80B, ASP80C, GLN21B, GLN21C, GLN84B, GLN84C, GLN86B, GLN86C, GLU18B, GLU18C, GLU49C, GLU53C, GLU90B, GLU90C, GLY20B, GLY20C, GLY29B, GLY33B, GLY33C, GLY52C, GLY71C, HIS41B, HIS82B, HIS82C, ILE25B, ILE25C, ILE46C, ILE67C, ILE83B, ILE83C, ILE87B, ILE87C, LEU13B, LEU13C, LEU14B, LEU14C, LEU23B, LEU23C, LEU55C, LEU56C, LEU65C, LYS15B, LYS15C, PHE44C, PHE85B, PHE85C, PRO11B, PRO11C, PRO27B, PRO69C, PRO81B, PRO81C, PRO89B, PRO89C, SER16B, SER16C, SER79B, SER88B, SER88C, THR17B, THR17C, THR19B, THR19C, THR30B, THR30C, THR34B, THR34C, THR72C, TYR22B, TYR22C, VAL12B, VAL12C, VAL31B, VAL31C, VAL54C, VAL73C