3OMX

crystal structure of ssu72 with vanadate complex

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 45
  • Norm. En. per Res.: -4.03
• 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	-43.5804	-70.0202	-92.7473	-206.3478	54	12	0	4247	6	43	27
A-C	-13.6948	28.1744	-65.0922	-50.6126	51	3	1	2638	7	20	20
A-D	-52.9219	-62.636	-65.7924	-181.3502	45	5	0	3042	10	42	31
B-C	0.0	2.2387	-75.7055	-73.4668	54	2	2	2903	0	16	22
B-D	0.0	0.0	-3.0898	-3.0898	3	1	0	107	0	0	6

Interface residues

• A-B: ALA146B, ALA149B, ALA153B, ALA164A, ALA28B, ARG183A, ARG183B, ARG184A, ARG184B, ARG88B, ARG91B, ASN161A, ASN161B, ASN171A, ASN25B, ASP148B, ASP158A, ASP158B, ASP168A, ASP170A, ASP172A, ASP174A, ASP87B, GLN178A, GLU147B, GLU175A, GLU179A, GLU181A, GLU182A, GLU22B, GLY152B, GLY81B, HIS84B, ILE173A, ILE177A, ILE92B, LEU150B, LEU169A, LEU176A, LYS165A, LYS185A, LYS29B, LYS30B, MET151B, MET162A, MET163A, PHE154B, PHE180A, PHE180B, PHE26B, SER166A, THR157B, THR167A, VAL155B
• A-C: ALA146A, ALA146C, ALA149A, ALA149C, ALA153A, ALA153C, ARG183A, ARG183C, ARG184A, ARG184C, ARG186C, ASN145A, ASN145C, ASN161A, ASN161C, ASP148A, ASP148C, ASP158A, ASP158C, GLN79A, GLN79C, GLU147A, GLU147C, GLU22A, GLU22C, GLY152C, GLY81A, GLY81C, HIS84A, HIS84C, LEU150A, LEU150C, LYS165A, LYS165C, LYS29A, LYS29C, LYS30A, LYS30C, MET151A, MET151C, MET85A, PHE154A, PHE154C, PHE26A, PHE26C, THR157A, THR157C, THR78A, THR78C, VAL155A, VAL155C
• A-D: ARG115A, ARG186A, ARG67D, ARG90D, ARG91D, ASN139A, ASN89D, ASP118A, ASP170A, ASP174A, ASP64D, ASP68D, ASP87D, GLN178A, GLU113A, GLU114A, GLU125A, GLU175A, GLU181A, GLU182A, GLU63D, GLU70D, HIS136A, HIS190A, ILE173A, ILE177A, ILE188A, ILE92D, LEU119A, LEU138A, LEU189A, LEU193A, LYS61D, LYS93D, LYS94D, SER191A, SER71D, TYR117A, TYR62D, TYR66D, VAL116A, VAL121A, VAL137A, VAL187A, VAL192A
• B-C: ALA49B, ALA49C, ARG115B, ARG115C, ARG19B, ARG19C, ASN145B, ASN145C, ASN18B, ASN54B, ASN80B, ASN80C, ASP141C, ASP144B, ASP144C, ASP148B, ASP148C, ASP51B, ASP51C, ASP73B, ASP73C, GLN79B, GLN79C, GLU147B, GLU75B, GLU75C, GLY47B, GLY47C, LEU45B, LEU82B, LYS44B, LYS44C, LYS52B, LYS52C, MET151B, MET17B, MET48B, MET48C, PHE50B, PHE50C, PHE76B, PHE76C, PRO46B, PRO46C, PRO53B, PRO53C, SER14B, SER15B, THR78B, VAL142C, VAL143B, VAL143C, VAL43B, VAL55B
• B-D: ARG91B, ARG91D, LYS29B