3I9H

crystal structure of a betagamma-crystallin domain from clostridium beijerinckii

• Total interactions analyzed: 28
• Total true interactions: 10
• Strongest Interaction:
  • Chains: B-G
  • Int. Res.: 37
  • Norm. En. per Res.: -3.6752
• Hub Node: B(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-C	0.0	4.202	-12.7135	-8.5115	28	0	0	837	0	3	5
A-H	-46.6116	0.872	-85.2478	-130.9874	39	8	0	3454	0	4	3
B-D	0.0	-0.9637	-7.4086	-8.3723	20	0	0	444	0	2	4
B-E	-12.0042	-4.2815	-58.1388	-74.4244	36	11	1	2990	0	6	2
B-G	-45.6473	0.8907	-91.2269	-135.9835	37	5	0	3484	0	4	3
C-E	-38.6921	0.8691	-85.5838	-123.4068	39	5	0	3429	0	4	3
D-F	-41.8447	0.9398	-86.3686	-127.2734	38	6	0	3343	0	4	3
D-G	0.0	0.0	-0.0237	-0.0237	2	0	0	7	0	2	1
E-H	-5.1384	0.0	-30.614	-35.7525	26	1	0	1631	0	1	5
F-G	0.0	2.4823	-37.6855	-35.2032	31	3	0	1943	0	1	6

Interface residues

• A-C: ALA15A, ALA32A, ASN11C, ASN30A, ASP68C, GLU8A, GLY13A, GLY14A, GLY47C, LEU19A, LYS2C, LYS33A, LYS43A, LYS43C, PRO45C, PRO70C, SER16A, SER18A, SER46C, SER67C, THR31A, THR5A, TRP48C, TYR12A, TYR12C, TYR7A, TYR7C, VAL17A
• A-H: ALA32A, ASN23A, ASN55H, ASN57A, ASN57H, ASP51H, ASP56H, ASP75H, GLN20A, GLN28A, GLU54H, GLY22A, GLY60H, ILE85A, LEU19A, LEU29A, LYS62H, LYS84A, LYS84H, PHE58A, PHE58H, PRO21A, SER27A, SER82A, SER82H, SER87A, THR25A, THR31A, THR59H, THR61H, THR64H, THR81H, THR88A, TRP63H, TYR24A, TYR53H, TYR86A, VAL52H, VAL83A
• B-D: ALA15B, ALA32B, ASN11D, ASP68D, GLY14B, GLY47D, LYS2D, LYS33B, LYS43D, PRO45D, SER16B, SER18B, SER46D, THR31B, THR5B, TYR12D, TYR7B, TYR7D, VAL17B, VAL44D
• B-E: ALA32E, ALA3E, ALA76B, ASN11B, ASN74B, ASN77B, ASP68E, ASP75B, ASP78B, ASP9B, GLN20E, GLU8B, GLY73B, ILE10B, LEU19E, LYS2E, LYS33E, LYS43E, LYS79B, PRO45E, PRO70B, SER16E, SER18E, SER46E, THR1E, THR40B, THR5E, TRP48E, TRP71B, TYR12B, TYR24E, TYR7E, VAL17E, VAL44E, VAL4E, VAL72B
• B-G: ALA32B, ASN23B, ASN55G, ASN57B, ASN57G, ASP51G, ASP56G, ASP75G, GLN20B, GLN28B, GLU54G, GLY22B, GLY60G, ILE85B, LEU19B, LEU29B, LYS62G, LYS84B, LYS84G, PHE58B, PHE58G, PRO21B, SER27B, SER82B, SER87B, THR25B, THR31B, THR59G, THR61G, THR64G, THR88B, TRP63G, TYR24B, TYR53G, TYR86B, VAL52G, VAL83B
• C-E: ALA32C, ASN23C, ASN55E, ASN57C, ASN57E, ASP51E, ASP56E, ASP75E, GLN20C, GLN28C, GLU54E, GLY22C, GLY60E, ILE85C, LEU19C, LEU29C, LYS62E, LYS84C, LYS84E, PHE58C, PHE58E, PRO21C, SER27C, SER82C, SER82E, SER87C, THR25C, THR31C, THR59E, THR61E, THR64E, THR81E, THR88C, TRP63E, TYR24C, TYR53E, TYR86C, VAL52E, VAL83C
• D-F: ALA32D, ASN23D, ASN55F, ASN57D, ASN57F, ASP51F, ASP56F, ASP75F, GLN20D, GLN28D, GLU54F, GLY22D, GLY60F, ILE85D, LEU19D, LEU29D, LYS62F, LYS84D, LYS84F, PHE58D, PHE58F, PRO21D, SER27D, SER82D, SER87D, THR25D, THR31D, THR59F, THR61F, THR64F, THR81F, THR88D, TRP63F, TYR24D, TYR53F, TYR86D, VAL52F, VAL83D
• D-G: ASP75G, LYS2D
• E-H: ALA76E, ASN11E, ASN11H, ASN74E, ASN74H, ASN77H, ASP68E, ASP75E, ASP78H, ASP9H, GLY13H, GLY73E, GLY73H, ILE10E, ILE10H, PRO70E, PRO70H, THR40H, THR69E, TRP71E, TRP71H, TYR12E, TYR12H, TYR65E, VAL72E, VAL72H
• F-G: ALA76F, ASN11F, ASN11G, ASN74F, ASN74G, ASN77G, ASP68F, ASP75F, ASP78G, ASP9G, GLU8G, GLY13G, GLY14G, GLY73F, GLY73G, ILE10F, ILE10G, PRO70F, PRO70G, SER41F, SER67F, THR40F, THR40G, THR69F, TRP63F, TRP71F, TRP71G, TYR12F, TYR65F, VAL72F, VAL72G