3MJD

1.9 angstrom crystal structure of orotate phosphoribosyltransferase (pyre) francisella tularensis.

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 116
  • Norm. En. per Res.: -4.6917
• Hub Node: A(2)

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	-87.1467	1.0779	-458.173	-544.2418	116	14	20	16403	0	15	12
A-D	-50.6766	-9.076	-154.963	-214.7155	89	9	0	7082	1	29	26
C-D	-92.9366	8.6458	-440.543	-524.8339	117	17	19	16295	0	18	15

Interface residues

• A-B: ALA108A, ALA108B, ALA31A, ALA31B, ALA38A, ALA38B, ALA41A, ALA41B, ALA44A, ALA44B, ALA65A, ALA65B, ALA73A, ALA73B, ALA74A, ALA74B, ALA80A, ALA80B, ALA90A, ALA90B, ARG93A, ARG93B, ASN-7A, ASN30A, ASN35A, ASN35B, ASN84A, ASN84B, ASN9A, ASP109A, ASP109B, ASP45A, ASP45B, ASP59B, ASP86A, ASP86B, ASP92A, ASP92B, GLN-3A, GLN39A, GLN39B, GLU95A, GLY103B, GLY107A, GLY107B, GLY32A, GLY32B, GLY37A, GLY37B, GLY68A, GLY68B, ILE60A, ILE60B, ILE69A, ILE69B, ILE75A, ILE75B, ILE85A, ILE85B, LEU-6A, LEU33A, LEU33B, LEU40A, LEU40B, LEU43A, LEU43B, LEU61A, LEU61B, LEU71A, LEU71B, LEU79A, LEU79B, LEU81A, LEU81B, LYS20A, LYS67A, LYS67B, LYS82A, LYS82B, LYS94A, LYS94B, MET87A, MET87B, PHE-4A, PHE105B, PHE34A, PHE34B, PHE91A, PHE91B, PRO64A, PRO64B, PRO70A, PRO70B, PRO88A, PRO88B, SER76A, SER76B, THR36A, THR36B, THR42A, THR42B, THR77A, THR77B, TYR-5A, TYR66A, TYR66B, TYR83A, TYR83B, TYR89A, TYR89B, VAL106A, VAL106B, VAL72A, VAL72B, VAL78A, VAL78B
• A-D: ALA124D, ALA127D, ALA140D, ALA143A, ALA143D, ALA155D, ALA162A, ALA176A, ARG203A, ASN133D, ASN139D, ASN171A, ASN171D, ASN179A, ASP150A, ASP157D, ASP159D, ASP169A, ASP169D, ASP55A, GLN152A, GLN168A, GLN168D, GLN204D, GLN49A, GLU130D, GLU181A, GLU185A, GLU189A, GLY125D, GLY144A, ILE137D, ILE138D, ILE142A, ILE142D, ILE160A, ILE160D, ILE166A, ILE166D, ILE172A, ILE172D, ILE51A, LEU135D, LEU175A, LEU50A, LYS113D, LYS114A, LYS114D, LYS134D, LYS136D, LYS141A, LYS141D, LYS154D, LYS156D, LYS164A, LYS164D, LYS165A, LYS165D, LYS188A, LYS53A, LYS57A, MET1A, PHE128D, PHE170A, PHE170D, PHE180A, PHE2A, PRO173A, PRO173D, SER158D, SER161A, SER167A, SER167D, SER182A, SER208A, SER208D, SER54A, THR126D, THR163A, THR178A, TYR129D, TYR132A, TYR132D, TYR46A, VAL145A, VAL146A, VAL174A, VAL177A, VAL56A
• C-D: ALA108C, ALA108D, ALA31C, ALA31D, ALA38C, ALA38D, ALA41C, ALA41D, ALA44C, ALA44D, ALA65C, ALA65D, ALA73C, ALA73D, ALA74C, ALA74D, ALA80C, ALA80D, ALA90C, ALA90D, ARG93C, ARG93D, ASN-7D, ASN30C, ASN35C, ASN35D, ASN84C, ASN84D, ASP109C, ASP109D, ASP45C, ASP45D, ASP59C, ASP86C, ASP86D, ASP92C, ASP92D, GLN-3D, GLN39C, GLN39D, GLU-8D, GLU95C, GLU95D, GLY103C, GLY107C, GLY107D, GLY32C, GLY32D, GLY37C, GLY37D, GLY68C, GLY68D, ILE60C, ILE60D, ILE69C, ILE69D, ILE75C, ILE75D, ILE85C, ILE85D, LEU-6D, LEU33C, LEU33D, LEU40C, LEU40D, LEU43C, LEU43D, LEU61C, LEU61D, LEU71C, LEU71D, LEU79C, LEU79D, LEU81C, LEU81D, LYS20D, LYS67C, LYS67D, LYS82C, LYS82D, LYS94C, LYS94D, MET87C, MET87D, PHE-4D, PHE34C, PHE34D, PHE91C, PHE91D, PRO64C, PRO64D, PRO70C, PRO70D, PRO88C, PRO88D, SER76C, SER76D, THR-9D, THR36C, THR36D, THR42C, THR42D, THR77C, THR77D, TYR-5D, TYR66C, TYR66D, TYR83C, TYR83D, TYR89C, TYR89D, VAL106C, VAL106D, VAL72C, VAL72D, VAL78C, VAL78D