3GLS

crystal structure of human sirt3

• Total interactions analyzed: 15
• Total true interactions: 8
• Strongest Interaction:
  • Chains: E-F
  • Int. Res.: 73
  • Norm. En. per Res.: -2.3815
• Hub Node: C(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	-2.3748	0.0	-166.44	-168.8148	74	5	0	5439	0	8	13
A-D	0.0	-0.2694	-99.5273	-99.7967	50	8	7	4938	0	5	10
B-C	0.0	1.3709	-98.8737	-97.5028	51	8	7	4987	0	5	11
C-D	-3.1566	-6.7176	-159.405	-169.2792	73	7	0	5354	0	9	14
C-E	0.0	-5.1813	-63.492	-68.6733	62	6	0	3816	0	12	12
C-F	-3.5171	-7.4687	-8.1629	-19.1487	14	0	0	411	0	5	5
D-E	-8.6167	4.7106	-31.5103	-35.4164	34	1	2	1783	0	15	16
E-F	-5.2577	-12.0832	-156.512	-173.8529	73	4	0	5405	0	10	16

Interface residues

• A-B: ALA178A, ALA178B, ALA352A, ALA352B, ARG158A, ARG158B, ASN167A, ASN167B, ASP172A, ASP172B, ASP346A, ASP346B, GLN169A, GLN169B, GLN170A, GLN170B, GLU177A, GLU177B, GLU323A, GLU323B, GLU325A, GLU325B, GLU332A, GLU332B, GLY161A, GLY161B, GLY349A, GLY349B, HIS354A, HIS354B, ILE179A, ILE179B, LEU164A, LEU164B, LEU168A, LEU168B, LEU173A, LEU173B, LEU347A, LEU347B, LEU351A, LEU351B, LEU363A, PHE157A, PHE157B, PHE184B, PRO160A, PRO160B, PRO174A, PRO174B, PRO176A, PRO176B, PRO191A, PRO191B, PRO350A, PRO350B, PRO355A, PRO355B, SER159A, SER159B, SER162B, SER166A, SER166B, SER329B, TRP353A, TRP353B, TYR165A, TYR165B, TYR171A, TYR171B, TYR175A, TYR175B, VAL348A, VAL348B
• A-D: ALA333A, ARG139A, ARG224A, ARG279D, ARG301A, ARG356A, ASN188D, ASP308A, CYS256D, CYS259D, CYS280D, CYS283D, GLN260D, GLN300A, GLU332A, GLY285D, HIS187D, HIS305A, LEU182D, LEU223A, LEU303A, LEU304A, LEU330A, LYS190D, LYS288D, MET311A, PHE184D, PHE185D, PHE186D, PHE193D, PHE302A, PHE309A, PRO183D, PRO189D, PRO278D, PRO299A, PRO310A, SER242A, SER329A, THR257D, THR284D, TYR226A, VAL245A, VAL258D, VAL277D, VAL282D, VAL286D, VAL287D, VAL306A, VAL307A
• B-C: ALA333C, ARG139C, ARG224C, ARG261B, ARG276B, ARG279B, ARG301C, ARG335C, ASN188B, ASP308C, CYS256B, CYS259B, CYS280B, CYS283B, GLN260B, GLN300C, GLU332C, GLY285B, HIS187B, HIS305C, LEU182B, LEU223C, LEU303C, LEU304C, LEU330C, LYS190B, LYS243C, LYS288B, MET311C, PHE184B, PHE185B, PHE186B, PHE193B, PHE302C, PRO183B, PRO189B, PRO278B, PRO299C, PRO310C, SER242C, THR257B, THR284B, TYR226C, VAL245C, VAL258B, VAL277B, VAL282B, VAL286B, VAL287B, VAL306C, VAL307C
• C-D: ALA178C, ALA178D, ALA328D, ALA352C, ALA352D, ARG158C, ARG158D, ASN167C, ASN167D, ASP172C, ASP172D, ASP346C, ASP346D, GLN169C, GLN169D, GLN170C, GLN170D, GLU177C, GLU177D, GLU323C, GLU323D, GLU325C, GLU325D, GLU332C, GLU332D, GLY161D, GLY349C, GLY349D, HIS354C, HIS354D, ILE179C, ILE179D, LEU164C, LEU164D, LEU168C, LEU168D, LEU173C, LEU173D, LEU347C, LEU347D, LEU351C, LEU351D, PHE157C, PHE157D, PHE184D, PRO160C, PRO160D, PRO174C, PRO174D, PRO176C, PRO176D, PRO191C, PRO191D, PRO350C, PRO350D, PRO355C, PRO355D, SER159C, SER159D, SER166C, SER166D, SER329C, SER329D, TRP353C, TRP353D, TYR165C, TYR165D, TYR171C, TYR171D, TYR175C, TYR175D, VAL348C, VAL348D
• C-E: ALA129E, ALA134E, ALA136E, ALA333E, ARG133E, ARG135E, ARG335E, ARG345C, ARG356E, ARG358E, ASN167C, ASN203C, ASN207C, ASP127E, ASP156C, ASP359E, ASP365C, GLN126E, GLN169C, GLU130E, GLU198C, GLU371C, GLY121E, GLY147C, GLY153C, GLY161C, GLY163C, GLY202C, HIS368C, ILE132E, ILE154C, LEU123E, LEU125E, LEU131E, LEU164C, LEU199C, LYS122E, LYS205C, MET273C, PRO151C, PRO155C, PRO160C, PRO310E, PRO339E, PRO355E, SER124E, SER149C, SER152C, SER159C, SER162C, SER166C, SER336E, SER337E, SER357E, THR150C, TYR165C, TYR204C, VAL128E, VAL208C, VAL334E, VAL338E, VAL367C
• C-F: ARG384C, ASN188F, ASP172F, ASP385C, GLN169F, GLN170F, GLN388C, GLU381C, GLY392C, HIS187F, LEU168F, LEU173F, THR391C, TYR171F
• D-E: ALA134E, ALA136E, ALA352D, ALA361D, ARG133E, ARG135E, ARG139E, ARG345D, ASN344D, ASP218E, ASP346D, ASP365D, CYS137E, GLN138E, GLN362D, GLU130E, GLU381E, GLU382E, GLY121D, GLY220E, GLY364D, GLY378E, HIS368D, ILE132E, LEU131E, LEU221E, LEU347D, LEU351D, LEU363D, LYS122D, LYS219E, PRO355D, SER124D, VAL348D
• E-F: ALA178E, ALA178F, ALA352E, ALA352F, ARG158E, ARG158F, ASN167E, ASN167F, ASP172E, ASP172F, ASP346E, ASP346F, GLN169E, GLN169F, GLN170E, GLN170F, GLU177E, GLU177F, GLU323E, GLU323F, GLU325E, GLU325F, GLU332E, GLU332F, GLY161E, GLY161F, GLY349E, GLY349F, HIS354E, HIS354F, ILE179E, ILE179F, LEU164E, LEU164F, LEU168E, LEU168F, LEU173E, LEU173F, LEU347E, LEU347F, LEU351E, LEU351F, PHE157E, PHE157F, PHE184E, PRO160E, PRO160F, PRO174E, PRO174F, PRO176E, PRO176F, PRO191E, PRO191F, PRO350E, PRO350F, PRO355E, PRO355F, SER159E, SER159F, SER166E, SER166F, SER329E, SER329F, TRP353E, TRP353F, TYR165E, TYR165F, TYR171E, TYR171F, TYR175E, TYR175F, VAL348E, VAL348F