2OST

the structure of a bacterial homing endonuclease : i-ssp6803i

• Total interactions analyzed: 15
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 78
  • Norm. En. per Res.: -3.5738
• 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	-33.4983	-5.0241	-145.268	-183.7904	56	10	0	5683	0	17	27
A-C	-80.8357	-13.923	-184.0	-278.7586	78	14	8	8087	1	18	20
A-D	-5.7018	-17.3498	-101.398	-124.4496	60	1	3	4912	1	18	7
B-C	-5.0372	-8.1498	-104.282	-117.469	63	6	3	5185	1	18	7
B-D	-58.4181	-14.035	-162.87	-235.3231	78	11	7	7648	0	18	20
C-D	0.0	11.1805	-34.3743	-23.1939	31	0	0	1705	0	14	11

Interface residues

• A-B: ARG32A, ARG32B, ARG70B, ARG73A, ARG73B, ARG74A, ARG74B, ARG78A, ARG78B, ASN72A, ASN72B, ASN75A, ASN75B, ASP31A, ASP31B, ASP8A, ASP8B, GLN11A, GLN11B, GLN12A, GLN12B, GLY1A, GLY1B, GLY30A, GLY30B, GLY7A, GLY7B, ILE15A, ILE76A, ILE76B, ILE9A, ILE9B, LEU29A, LEU29B, LEU33A, LEU33B, LEU37A, LEU5A, LEU5B, LYS27A, LYS27B, LYS4A, LYS4B, LYS6A, LYS6B, PRO28A, PRO28B, SER2A, SER2B, THR3A, THR3B, THR69B, THR71A, THR71B, VAL77A, VAL77B
• A-C: ALA18A, ALA18C, ARG32A, ARG32C, ASN84A, ASP36A, ASP36C, ASP40A, ASP40C, ASP85A, ASP85C, ASP87A, ASP87C, GLN11A, GLN12A, GLN145A, GLN145C, GLU42A, GLU42C, GLY22A, GLY22C, GLY24A, GLY24C, GLY30A, GLY30C, GLY43A, GLY43C, ILE15A, ILE15C, ILE44A, ILE44C, LEU19A, LEU19C, LEU26A, LEU26C, LEU29A, LEU29C, LEU33A, LEU33C, LEU37A, LEU37C, LEU45A, LEU45C, LEU46A, LEU46C, LYS141A, LYS146C, LYS20A, LYS20C, LYS27A, LYS27C, LYS47A, LYS47C, MET16A, MET21A, MET21C, PHE39A, PHE39C, PHE86A, PHE86C, PRO28A, PRO28C, SER149C, SER34A, SER34C, THR148C, TRP23A, TRP23C, TYR35A, TYR35C, VAL25A, VAL25C, VAL38A, VAL38C, VAL41A, VAL41C, VAL48A, VAL48C
• A-D: ALA10A, ALA10D, ALA13A, ALA13D, ALA14A, ALA14D, ALA18A, ALA18D, ARG17A, ARG17D, ASP8A, ASP8D, GLN11A, GLN11D, GLN12A, GLN12D, GLU94A, GLU94D, GLU95A, GLU95D, GLU97A, GLU97D, GLY1A, GLY22A, GLY22D, GLY24A, GLY24D, GLY7A, GLY7D, ILE15A, ILE15D, ILE9A, ILE9D, LEU19A, LEU19D, LEU37A, LEU37D, LEU5A, LEU5D, LYS20A, LYS20D, LYS27A, LYS27D, LYS4A, LYS6A, LYS6D, MET0A, MET16A, MET16D, MET21A, MET21D, PHE99A, PHE99D, TRP23A, TRP23D, TYR92A, TYR92D, VAL25A, VAL25D, VAL93D
• B-C: ALA10B, ALA10C, ALA13B, ALA13C, ALA14B, ALA14C, ALA18B, ALA18C, ARG17B, ARG17C, ASP8B, ASP8C, GLN11B, GLN11C, GLN12B, GLN12C, GLU42B, GLU94B, GLU94C, GLU95B, GLU95C, GLU97B, GLU97C, GLY1B, GLY1C, GLY22B, GLY22C, GLY24B, GLY24C, GLY7B, GLY7C, ILE15B, ILE15C, ILE9B, ILE9C, LEU19B, LEU19C, LEU29B, LEU29C, LEU37B, LEU37C, LEU5B, LEU5C, LYS20B, LYS20C, LYS27B, LYS27C, LYS4B, LYS6B, LYS6C, MET0C, MET16B, MET16C, MET21B, MET21C, PHE99B, PHE99C, TRP23B, TRP23C, TYR92B, TYR92C, VAL25B, VAL25C
• B-D: ALA18B, ALA18D, ARG32B, ARG32D, ASN84B, ASN84D, ASP36B, ASP36D, ASP40B, ASP40D, ASP85B, ASP85D, ASP87B, ASP87D, GLN11B, GLN12B, GLN12D, GLN145B, GLU42B, GLU42D, GLY22B, GLY22D, GLY24B, GLY24D, GLY30B, GLY30D, GLY43B, GLY43D, ILE15B, ILE15D, ILE44B, ILE44D, LEU19B, LEU19D, LEU26B, LEU26D, LEU29B, LEU29D, LEU33B, LEU33D, LEU37B, LEU37D, LEU45B, LEU45D, LEU46B, LEU46D, LYS146B, LYS146D, LYS27B, LYS27D, LYS47B, LYS47D, MET16B, MET16D, MET21D, PHE39B, PHE39D, PHE86B, PHE86D, PRO28B, PRO28D, SER149D, SER34B, SER34D, THR148B, THR148D, TRP23B, TRP23D, TYR35B, TYR35D, VAL25B, VAL25D, VAL38B, VAL38D, VAL41B, VAL41D, VAL48B, VAL48D
• C-D: ARG32C, ARG32D, ASP31C, ASP31D, ASP8C, ASP8D, GLN11C, GLN11D, GLN12C, GLN12D, GLY1C, GLY30C, GLY30D, ILE15C, ILE15D, ILE9C, ILE9D, LEU29C, LEU29D, LEU33C, LEU33D, LEU5C, LEU5D, LYS27C, LYS4C, LYS4D, LYS6D, MET0C, SER2C, SER2D, THR3D