3LUM

structure of ulilysin mutant m290l

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 120
  • Norm. En. per Res.: -3.0874
• 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	-28.0356	-25.7009	-96.2493	-149.9857	51	3	0	3432	0	12	11
A-C	-30.7792	-62.585	-277.128	-370.4922	120	8	1	11022	4	37	59
B-D	0.0	0.0	-3.8782	-3.8782	12	0	0	270	0	0	1
C-D	-27.216	-24.3346	-91.9075	-143.4581	50	2	0	3290	0	11	12

Interface residues

• A-B: ALA126A, ALA85A, ALA85B, ARG140A, ARG140B, ASN131A, ASN131B, ASN133A, ASN133B, ASN81A, ASN81B, ASP129A, ASP129B, ASP84A, ASP84B, GLN134A, GLN134B, GLN142A, GLN142B, GLN88A, GLN88B, GLU78A, GLU78B, GLY132A, GLY132B, GLY137A, GLY137B, ILE138A, ILE138B, ILE82A, ILE82B, ILE87A, ILE87B, LEU125A, LEU125B, LYS128A, LYS128B, PRO130A, PRO130B, SER83A, SER83B, THR127A, THR127B, THR135A, THR135B, THR136A, THR136B, TRP75A, TRP75B, VAL73A, VAL73B
• A-C: ALA157A, ALA157C, ALA191A, ALA191C, ALA198A, ALA198C, ALA263A, ALA263C, ARG245A, ARG245C, ARG252A, ARG252C, ARG308A, ASP152A, ASP152C, ASP163A, ASP163C, ASP186A, ASP186C, ASP201A, ASP201C, ASP242A, ASP242C, ASP248A, ASP248C, ASP254A, ASP254C, ASP264A, ASP264C, CYS250A, CYS250C, GLN185A, GLN185C, GLN192A, GLN192C, GLU153A, GLU153C, GLU182A, GLU182C, GLU199A, GLU199C, GLU243A, GLU243C, GLU247A, GLU247C, GLU255A, GLU255C, GLY160A, GLY160C, GLY161A, GLY161C, GLY184A, GLY184C, GLY195A, GLY195C, GLY196A, GLY196C, GLY241A, GLY241C, HIS232A, HIS232C, HIS238A, HIS238C, ILE183A, ILE183C, ILE187A, ILE187C, LEU244A, LEU244C, LYS155A, LYS155C, PHE147A, PHE147C, PHE148A, PHE148C, PHE156A, PHE156C, PHE193A, PHE193C, PHE246A, PHE246C, PHE267A, PHE267C, PRO194A, PRO194C, PRO197A, PRO197C, PRO249A, PRO249C, PRO265A, PRO265C, SER151A, SER151C, SER158A, SER158C, SER159A, SER159C, SER181A, SER181C, SER251A, SER251C, SER253A, SER253C, THR149A, THR149C, THR150A, THR150C, THR200A, THR200C, TRP240A, TRP240C, TYR190A, TYR190C, TYR237A, TYR237C, TYR292A, TYR292C, VAL145C, VAL154A, VAL154C
• B-D: ASN76B, ASN76D, GLN142B, GLN142D, GLU77B, GLU77D, SER144B, SER144D, THR146B, THR146D, VAL145B, VAL145D
• C-D: ALA85C, ALA85D, ARG140C, ARG140D, ASN131C, ASN131D, ASN133C, ASN133D, ASN81C, ASN81D, ASP129C, ASP129D, ASP84C, ASP84D, GLN134C, GLN134D, GLN142C, GLN142D, GLN88C, GLU78C, GLU78D, GLY132C, GLY132D, GLY137C, GLY137D, ILE138C, ILE138D, ILE82C, ILE82D, ILE87C, ILE87D, LEU125C, LEU125D, LYS128C, LYS128D, PRO130C, PRO130D, SER83C, SER83D, THR127C, THR127D, THR135C, THR135D, THR136C, THR136D, TRP165D, TRP75C, TRP75D, VAL73C, VAL73D