1VQ3

crystal structure of phosphoribosylformylglycinamidine synthase, purs subunit (ec 6.3.5.3) (tm1244) from thermotoga maritima at 1.90 a resolution

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 126
  • Norm. En. per Res.: -6.1684
• 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	-226.9536	-105.4955	-444.763	-777.2122	126	24	23	18860	11	73	61
A-C	0.0	1.9344	-14.1474	-12.213	18	1	0	752	0	9	7
A-D	-41.7671	0.2734	-124.374	-165.8677	48	6	1	4591	3	36	36
B-C	-32.4393	1.1964	-126.957	-158.1999	48	8	1	4534	3	37	34
B-D	0.0	0.0	-13.402	-13.402	14	0	1	677	0	10	11
C-D	-206.0179	-97.1437	-427.0	-730.1616	124	25	25	18139	10	72	63

Interface residues

• A-B: ALA51A, ALA51B, ALA57A, ALA57B, ALA64A, ALA64B, ALA7A, ALA7B, ARG20A, ARG20B, ARG26A, ARG26B, ARG29A, ARG29B, ARG40A, ARG40B, ARG80A, ARG80B, ASP18B, ASP9A, ASP9B, CYS65A, CYS65B, GLN11A, GLN11B, GLU25A, GLU25B, GLU31A, GLU31B, GLU48A, GLU48B, GLU50A, GLU50B, GLU52A, GLU52B, GLU59A, GLU59B, GLU66A, GLU66B, GLU67A, GLU67B, GLU76A, GLU76B, GLU78A, GLU78B, GLY21A, GLY21B, GLY33A, GLY33B, GLY42A, GLY42B, HIS0B, HIS46A, HIS46B, ILE24A, ILE24B, ILE45A, ILE45B, ILE60A, ILE60B, ILE8A, ILE8B, LEU1A, LEU1B, LEU28A, LEU28B, LEU34A, LEU34B, LEU39A, LEU39B, LEU3A, LEU3B, LEU41A, LEU41B, LEU47A, LEU47B, LEU68A, LEU68B, LEU69A, LEU69B, LEU82A, LEU82B, LYS32A, LYS32B, LYS37A, LYS37B, LYS38A, LYS38B, LYS43A, LYS43B, LYS56A, LYS56B, LYS5A, LYS5B, LYS62A, LYS62B, LYS63A, LYS63B, PHE4A, PHE4B, PHE6A, PHE6B, PRO2A, PRO2B, PRO35A, PRO35B, SER44A, SER44B, THR23A, THR23B, TYR77A, TYR77B, VAL10A, VAL10B, VAL27A, VAL27B, VAL36A, VAL36B, VAL49A, VAL49B, VAL61A, VAL61B, VAL70A, VAL70B, VAL79A, VAL79B
• A-C: ARG13A, ARG13C, ARG40A, ARG40C, ASN15A, ASN15C, GLU76A, GLU76C, LYS37A, LYS37C, LYS38A, LYS38C, SER14A, SER14C, TYR12A, TYR12C, VAL16A, VAL16C
• A-D: ALA51D, ARG13A, ARG40A, ARG80A, ASN53D, ASN71A, ASP9A, CYS65A, GLN11A, GLU48D, GLU50D, GLU52D, GLU55A, GLU55D, GLU59A, GLU66A, GLU67A, GLU75A, GLU76A, GLU78A, GLU81D, HIS-1D, HIS0D, ILE8A, LEU1D, LEU3D, LEU69A, LEU82D, LYS54A, LYS54D, LYS56D, LYS5D, LYS62A, LYS63A, PHE4D, PRO2D, PRO72A, SER14A, TYR12A, TYR58A, TYR77A, VAL10A, VAL49D, VAL61A, VAL70A, VAL73A, VAL74A, VAL79A
• B-C: ALA51B, ALA57B, ARG13C, ARG80C, ASN53B, ASN71C, ASP9C, CYS65C, GLN11C, GLU48B, GLU50B, GLU52B, GLU55B, GLU55C, GLU59C, GLU66C, GLU67C, GLU75C, GLU76C, GLU78C, GLU81B, GLU81C, HIS-1B, HIS0B, ILE8C, LEU1B, LEU3B, LEU69C, LEU82B, LYS54B, LYS56B, LYS5B, LYS62C, LYS63C, PHE4B, PRO2B, PRO72C, SER14C, TYR12C, TYR58C, TYR77C, VAL10C, VAL49B, VAL61C, VAL70C, VAL73C, VAL74C, VAL79C
• B-D: ALA7B, ALA7D, ARG80B, ARG80D, GLU81B, GLU81D, HIS46B, HIS46D, LEU3B, LEU3D, LEU82B, LEU82D, LYS5B, LYS5D
• C-D: ALA51C, ALA51D, ALA57C, ALA57D, ALA64C, ALA64D, ALA7C, ALA7D, ARG20D, ARG26C, ARG26D, ARG29C, ARG29D, ARG40C, ARG40D, ARG80C, ARG80D, ASP18C, ASP18D, ASP9C, ASP9D, CYS65C, CYS65D, GLN11C, GLN11D, GLU25C, GLU25D, GLU31C, GLU31D, GLU48C, GLU48D, GLU50C, GLU50D, GLU52C, GLU59C, GLU59D, GLU66C, GLU66D, GLU67C, GLU67D, GLU76C, GLU76D, GLU78C, GLU78D, GLY21C, GLY21D, GLY33C, GLY33D, GLY42C, GLY42D, HIS0D, HIS46C, HIS46D, ILE24C, ILE24D, ILE45C, ILE45D, ILE60C, ILE60D, ILE8C, ILE8D, LEU1C, LEU1D, LEU28C, LEU28D, LEU34C, LEU34D, LEU39C, LEU39D, LEU3C, LEU3D, LEU41C, LEU41D, LEU47C, LEU47D, LEU68C, LEU68D, LEU69C, LEU69D, LEU82C, LEU82D, LYS32C, LYS32D, LYS37C, LYS37D, LYS38C, LYS38D, LYS43C, LYS43D, LYS56C, LYS56D, LYS5C, LYS5D, LYS62C, LYS62D, LYS63C, LYS63D, PHE4C, PHE4D, PHE6C, PHE6D, PRO2D, PRO35C, PRO35D, SER44C, SER44D, THR23C, THR23D, TYR12C, TYR77D, VAL10C, VAL10D, VAL27C, VAL27D, VAL36C, VAL36D, VAL49C, VAL49D, VAL61C, VAL61D, VAL70C, VAL70D, VAL79C, VAL79D