2A6R

crystal structure of yoeb under peg condition

• Total interactions analyzed: 15
• Total true interactions: 8
• Strongest Interaction:
  • Chains: E-F
  • Int. Res.: 58
  • Norm. En. per Res.: -5.1329
• Hub Node: B(4)

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	-56.5922	-42.8927	-194.245	-293.7299	59	11	1	7992	2	40	19
A-C	0.0	0.0	-0.0714	-0.0714	2	0	0	23	0	0	0
B-C	-15.9452	-29.0817	-25.2834	-70.3104	16	1	0	996	3	9	11
B-D	0.0	0.0	-0.5166	-0.5166	9	0	0	63	0	7	3
B-E	0.0	0.0	-0.0117	-0.0117	4	0	0	13	0	0	2
B-F	-23.8563	-5.5316	-69.3244	-98.7124	20	3	0	2379	0	4	8
C-D	-64.0559	-31.4835	-197.115	-292.6545	59	13	1	8035	0	39	18
E-F	-60.0734	-43.3702	-194.263	-297.7066	58	8	2	8011	2	39	19

Interface residues

• A-B: ARG35A, ARG35B, ASN28A, ASN28B, ASP11A, ASP11B, ASP73A, ASP73B, GLN17A, GLN17B, GLU18A, GLU18B, GLU29A, GLU29B, GLU7A, GLU7B, GLU8A, GLU8B, ILE27A, ILE27B, ILE31A, ILE31B, ILE4A, ILE4B, ILE77A, ILE77B, LEU14A, LEU14B, LEU3A, LEU3B, LEU75A, LEU75B, LEU76A, LEU76B, LYS21A, LYS21B, LYS25A, LYS25B, LYS2A, LYS2B, LYS32A, LYS32B, MET1A, MET1B, SER6A, SER6B, SER74A, SER74B, SER9A, SER9B, TRP10A, TRP10B, TRP5A, TRP5B, TYR13A, TYR13B, TYR15B, VAL24A, VAL24B
• A-C: ARG22C, LYS25A
• B-C: ARG22C, ARG81B, ASP20B, ASP20C, GLN17C, GLU18B, GLU18C, HIS64B, LEU14B, LYS21C, THR19B, THR19C, TRP16C, TYR15B, TYR15C, TYR82B
• B-D: ARG22D, GLU63B, HIS64B, LYS21D, LYS25D, THR19B, TRP16B, TYR15B, TYR82B
• B-E: HIS50B, LYS21E, LYS25E, LYS49B
• B-F: ARG22F, ASN51B, ASP20F, GLN17F, GLU18F, GLY54B, HIS50B, HIS64F, ILE23F, LEU48B, LEU52B, LYS21F, LYS49B, PHE55B, PRO47B, SER53B, THR19F, TRP16F, TYR15F, VAL24F
• C-D: ARG35C, ARG35D, ASN28C, ASN28D, ASP11C, ASP11D, ASP73C, ASP73D, GLN17C, GLN17D, GLU18C, GLU18D, GLU29C, GLU29D, GLU7C, GLU7D, GLU8C, GLU8D, ILE27C, ILE27D, ILE31C, ILE31D, ILE4C, ILE4D, ILE77C, ILE77D, LEU14C, LEU14D, LEU3C, LEU3D, LEU75C, LEU75D, LEU76C, LEU76D, LYS21C, LYS21D, LYS25C, LYS25D, LYS2C, LYS2D, LYS32C, LYS32D, MET1C, MET1D, SER6C, SER6D, SER74C, SER74D, SER9C, SER9D, TRP10C, TRP10D, TRP5C, TRP5D, TYR13C, TYR13D, TYR15D, VAL24C, VAL24D
• E-F: ARG35E, ARG35F, ASN28E, ASN28F, ASP11E, ASP11F, ASP73E, ASP73F, GLN17E, GLN17F, GLU18E, GLU18F, GLU29E, GLU29F, GLU7E, GLU7F, GLU8E, GLU8F, ILE27E, ILE27F, ILE31E, ILE31F, ILE4E, ILE4F, ILE77E, ILE77F, LEU14E, LEU14F, LEU3E, LEU3F, LEU75E, LEU75F, LEU76E, LEU76F, LYS21E, LYS21F, LYS25E, LYS25F, LYS2E, LYS2F, LYS32E, LYS32F, MET1E, MET1F, SER6E, SER6F, SER74E, SER74F, SER9E, SER9F, TRP10E, TRP10F, TRP5E, TRP5F, TYR13E, TYR13F, VAL24E, VAL24F