2Y30

simocyclinone d8 bound form of tetr-like repressor simr

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 263
  • Norm. En. per Res.: -4.0366
• 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	-143.5561	-199.8442	-718.213	-1061.6133	263	28	12	26573	13	73	63

Interface residues

• A-B: ALA118A, ALA118B, ALA120A, ALA120B, ALA178A, ALA178B, ALA196A, ALA196B, ALA209A, ALA209B, ALA213A, ALA213B, ALA217A, ALA217B, ALA239A, ALA239B, ARG122A, ARG122B, ARG134A, ARG134B, ARG169A, ARG169B, ARG179A, ARG179B, ARG180A, ARG180B, ARG190B, ARG191A, ARG191B, ARG210A, ARG210B, ARG225A, ARG225B, ARG232A, ARG232B, ARG243A, ARG243B, ARG29A, ARG91B, ARG97A, ARG97B, ASN123A, ASN123B, ASN131A, ASN131B, ASN161A, ASN161B, ASN170A, ASN170B, ASP147A, ASP147B, ASP151A, ASP151B, ASP184A, ASP184B, ASP235A, ASP235B, ASP242A, ASP242B, ASP73A, ASP73B, GLN135A, GLN135B, GLN136A, GLN136B, GLN149A, GLN149B, GLN197A, GLN197B, GLN198A, GLN198B, GLU137A, GLU137B, GLU152A, GLU152B, GLU165A, GLU165B, GLU171A, GLU171B, GLU176A, GLU176B, GLU177A, GLU177B, GLU187B, GLU204A, GLU204B, GLU214A, GLU214B, GLU231A, GLU231B, GLU46A, GLU46B, GLU5A, GLU72A, GLU72B, GLU76A, GLU76B, GLY124A, GLY124B, GLY129A, GLY129B, GLY141A, GLY141B, GLY144A, GLY144B, GLY158A, GLY158B, GLY162A, GLY162B, GLY173A, GLY173B, GLY193A, GLY193B, GLY203A, GLY203B, GLY229A, GLY229B, GLY238A, GLY238B, GLY44A, GLY44B, 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, LEU234B, LEU241A, LEU241B, LEU244A, LEU244B, LYS71A, LYS71B, MET11A, MET185A, MET185B, MET189A, MET189B, MET207A, MET207B, MET220A, MET220B, PHE138A, PHE138B, PHE146A, PHE146B, PHE208A, PHE208B, PRO115A, PRO115B, PRO126A, PRO126B, PRO130A, PRO130B, PRO194A, PRO194B, PRO206A, PRO206B, PRO218A, PRO218B, PRO6A, PRO92A, PRO92B, SER132A, SER132B, SER155A, SER155B, SER166A, SER166B, SER192A, SER192B, SER202B, SER228A, SER228B, SER236A, SER236B, SER240A, SER240B, SER8A, SER8B, THR119A, THR119B, THR142A, THR142B, THR181A, THR181B, THR215A, THR215B, THR70A, THR70B, TRP10A, TRP10B, TRP111B, TRP116A, TRP116B, TRP121A, TRP121B, TRP128A, TRP128B, TRP174A, TRP174B, TRP188A, TRP188B, TYR160A, TYR160B, TYR163A, TYR163B, TYR195A, TYR195B, TYR205A, TYR205B, VAL127A, VAL127B, VAL139A, VAL139B, VAL145A, VAL145B, VAL150A, VAL150B, VAL172A, VAL172B, VAL183A, VAL183B, VAL200B, VAL211A, VAL211B, VAL216A, VAL216B, VAL45A, VAL45B, VAL7A