3ZQL

dna-bound form of tetr-like repressor simr

• Total interactions analyzed: 28
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 234
  • Norm. En. per Res.: -3.2083
• Hub Node: A(1)

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	-77.1032	-77.1782	-596.471	-750.7524	234	27	19	24550	6	66	59
B-C	0.0	2.8239	-57.5011	-54.6772	72	3	0	2525	1	49	46
C-D	-85.651	-58.2037	-599.522	-743.3768	236	16	20	24018	7	67	60

Interface residues

• A-B: ALA118A, ALA118B, ALA178A, ALA178B, ALA196A, ALA196B, ALA209A, ALA209B, ALA213A, ALA213B, ALA239A, ALA239B, ARG122A, ARG122B, ARG134A, ARG134B, ARG169A, ARG169B, ARG179B, ARG180A, ARG180B, ARG190A, ARG190B, ARG191A, ARG191B, ARG210A, ARG210B, ARG225A, ARG225B, ARG232A, ARG232B, ASN123A, ASN123B, ASN131A, ASN131B, ASN161A, ASN161B, ASN170A, ASN170B, ASP147A, ASP147B, ASP151A, ASP151B, ASP184A, ASP184B, ASP235A, ASP235B, GLN135A, GLN135B, GLN136A, GLN136B, GLN149A, GLN149B, GLN197A, GLN197B, GLN198A, GLN198B, GLN224B, GLU137A, GLU137B, GLU152A, GLU152B, GLU165A, GLU165B, GLU171A, GLU171B, GLU176A, GLU176B, GLU177A, GLU177B, GLU187A, GLU187B, GLU204A, GLU204B, GLU214A, GLU214B, GLU72A, GLU72B, GLU76A, GLU76B, GLY124A, GLY124B, GLY129A, GLY129B, GLY141A, GLY141B, GLY144A, GLY144B, GLY158A, GLY158B, GLY162A, GLY162B, GLY173A, GLY173B, GLY193A, GLY193B, GLY229A, GLY229B, HIS125A, HIS125B, HIS219A, HIS219B, ILE157A, ILE157B, ILE237A, ILE237B, ILE9A, ILE9B, LEU133A, LEU133B, LEU140A, LEU140B, LEU143A, LEU143B, LEU148A, LEU148B, LEU153A, LEU153B, LEU154A, LEU154B, LEU156A, LEU156B, LEU159A, LEU159B, LEU175A, LEU175B, LEU199A, LEU199B, LEU212A, LEU212B, LEU230A, LEU230B, LEU233A, LEU233B, LEU234A, LEU241A, MET11A, MET11B, MET185A, MET185B, MET189A, MET189B, MET207A, MET207B, MET220A, MET220B, PHE138A, PHE138B, PHE146A, PHE146B, PHE167A, PHE167B, PHE208A, PHE208B, PRO126A, PRO126B, PRO130A, PRO130B, PRO194A, PRO194B, PRO206A, PRO206B, PRO218A, PRO218B, PRO92A, PRO92B, SER132A, SER132B, SER155A, SER155B, SER166A, SER166B, SER192A, SER192B, SER202A, SER202B, SER228A, SER228B, SER236A, SER236B, SER240A, SER240B, SER8A, SER8B, THR119A, THR119B, THR142A, THR142B, THR181A, THR181B, THR215A, THR215B, TRP10A, TRP10B, TRP111A, TRP111B, TRP121A, TRP121B, TRP128A, TRP128B, TRP174A, TRP174B, TRP188A, TRP188B, TYR160A, TYR160B, TYR163A, TYR163B, TYR195A, TYR195B, TYR205A, TYR205B, VAL127A, VAL127B, VAL139A, VAL139B, VAL145A, VAL145B, VAL150A, VAL150B, VAL164A, VAL164B, VAL168A, VAL168B, VAL172A, VAL172B, VAL183A, VAL183B, VAL211A, VAL211B, VAL216A, VAL216B, VAL7A, VAL7B
• B-C: ALA109B, ALA109C, ALA213B, ALA217B, ALA217C, ALA98C, ARG108B, ARG108C, ARG113B, ARG113C, ARG186B, ARG186C, ARG190B, ARG190C, ARG191C, ARG225B, ARG225C, ARG227B, ARG227C, ARG34B, ARG34C, ARG87B, ARG87C, ASN105B, ASN105C, ASP184B, ASP184C, ASP223B, ASP223C, ASP41B, GLN224B, GLN224C, GLU106B, GLU106C, GLU187B, GLU187C, GLU214B, GLU231C, GLU85B, GLU85C, GLY221B, GLY221C, GLY84B, HIS114B, HIS219B, HIS219C, LEU102B, LEU102C, LEU110B, LEU110C, LEU112B, LEU212B, LYS182B, LYS182C, LYS38B, MET185B, MET189B, MET220B, MET220C, PRO218B, PRO218C, PRO222B, PRO222C, SER228B, THR101C, THR42B, THR42C, THR86B, THR86C, VAL183C, VAL216B, VAL82B
• C-D: ALA118C, ALA118D, ALA178C, ALA178D, ALA196C, ALA196D, ALA209C, ALA209D, ALA213C, ALA213D, ALA239C, ALA239D, ARG122C, ARG122D, ARG134C, ARG134D, ARG169C, ARG169D, ARG179D, ARG180C, ARG180D, ARG190C, ARG190D, ARG191C, ARG191D, ARG210C, ARG210D, ARG225C, ARG225D, ARG232C, ARG232D, ASN123C, ASN123D, ASN131C, ASN131D, ASN161C, ASN161D, ASN170C, ASN170D, ASP147C, ASP147D, ASP151C, ASP151D, ASP184C, ASP184D, ASP235C, ASP235D, GLN135C, GLN135D, GLN136C, GLN136D, GLN149C, GLN149D, GLN197C, GLN197D, GLN198C, GLN198D, GLU137C, GLU137D, GLU152C, GLU152D, GLU165C, GLU165D, GLU171C, GLU171D, GLU176C, GLU176D, GLU177C, GLU177D, GLU187C, GLU187D, GLU204C, GLU204D, GLU214C, GLU214D, GLU72C, GLU72D, GLU76C, GLU76D, GLY124C, GLY124D, GLY129C, GLY129D, GLY141C, GLY141D, GLY144C, GLY144D, GLY158C, GLY158D, GLY162C, GLY162D, GLY173C, GLY173D, GLY193C, GLY193D, GLY229C, GLY229D, HIS125C, HIS125D, HIS12D, HIS219C, HIS219D, ILE157C, ILE157D, ILE237C, ILE237D, ILE9C, ILE9D, LEU133C, LEU133D, LEU140C, LEU140D, LEU143C, LEU143D, LEU148C, LEU148D, LEU153C, LEU153D, LEU154C, LEU154D, LEU156C, LEU156D, LEU159C, LEU159D, LEU175C, LEU175D, LEU199C, LEU199D, LEU212C, LEU212D, LEU230C, LEU230D, LEU233C, LEU233D, LEU234C, LEU234D, MET11C, MET11D, MET185C, MET185D, MET189C, MET189D, MET207C, MET207D, MET220C, MET220D, PHE138C, PHE138D, PHE146C, PHE146D, PHE167C, PHE167D, PHE208C, PHE208D, PRO126C, PRO126D, PRO130C, PRO130D, PRO194C, PRO194D, PRO206C, PRO206D, PRO218C, PRO218D, PRO92C, PRO92D, SER132C, SER132D, SER155C, SER155D, SER166C, SER166D, SER192C, SER192D, SER202C, SER202D, SER228C, SER228D, SER236C, SER236D, SER240C, SER240D, SER8C, SER8D, THR119C, THR119D, THR142C, THR142D, THR181C, THR181D, THR215C, THR215D, THR70D, TRP10C, TRP10D, TRP111C, TRP111D, TRP121C, TRP121D, TRP128C, TRP128D, TRP174C, TRP174D, TRP188C, TRP188D, TYR160C, TYR160D, TYR163C, TYR163D, TYR195C, TYR195D, TYR205C, TYR205D, VAL127C, VAL127D, VAL139C, VAL139D, VAL145C, VAL145D, VAL150C, VAL150D, VAL164C, VAL164D, VAL168C, VAL168D, VAL172C, VAL172D, VAL183C, VAL183D, VAL200D, VAL211C, VAL211D, VAL216C, VAL216D, VAL7C, VAL7D