2CJS

structural basis for a munc13-1 dimeric - munc13-1 - rim heterodimer switch: c2-domains as versatile protein- protein interaction modules

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 109
  • Norm. En. per Res.: -4.7489
• 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	-13.2378	0.0	-105.713	-118.9508	60	2	2	4534	0	8	13
A-C	-115.7057	-60.8468	-341.077	-517.6295	109	28	11	13796	4	38	18
B-C	-40.8564	-5.0891	-142.155	-188.1005	53	7	0	5024	0	12	6

Interface residues

• A-B: ALA138A, ALA142A, ALA150A, ALA37B, ARG139A, ARG55A, ARG83A, ASN149A, ASN153A, ASN30B, ASN54A, ASP48B, ASP57A, GLN147A, GLN29A, GLN47B, GLU146A, GLU32B, GLU46B, GLU52B, GLY-1A, GLY-2A, GLY-3A, GLY68B, ILE-7A, ILE0A, ILE36B, ILE53A, ILE70B, LEU129A, LEU145A, LEU148A, LEU152A, LEU1A, LEU26B, LEU3B, LEU56A, LEU58A, LEU69B, LYS143A, LYS144A, LYS151A, LYS27B, MET50B, PHE49B, PHE51B, PRO130A, SER-6A, SER2A, SER33B, THR25B, THR34B, THR35B, THR73B, TRP141A, TRP45B, TRP71B, TYR23B, VAL24B, VAL31B
• A-C: ALA101C, ALA117C, ALA138A, ALA142A, ALA89C, ARG118C, ARG122C, ARG126C, ARG138C, ARG139A, ARG55A, ASN135C, ASN149A, ASN153A, ASN30A, ASN54A, ASN89A, ASP102C, ASP132A, ASP48A, CYS104C, CYS108C, CYS111C, CYS116C, CYS119C, CYS134C, CYS137C, CYS5A, CYS92C, CYS95C, GLN112C, GLN140C, GLN141C, GLN29A, GLN47A, GLU128A, GLU135A, GLU137A, GLU142C, GLU146A, GLU32A, GLU46A, GLU52A, GLU90A, GLU91A, GLY-1A, GLY-2A, GLY-3A, GLY-4A, GLY-5A, GLY-8A, GLY103C, GLY105C, GLY120C, GLY121C, GLY7A, HIS106C, HIS126A, HIS96C, ILE-7A, ILE0A, ILE133A, ILE53A, LEU125C, LEU129A, LEU131A, LEU136C, LEU145A, LEU148A, LEU152A, LEU1A, LEU26A, LEU3A, LEU4A, LYS114C, LYS129C, LYS139C, LYS143A, LYS144A, LYS97C, LYS99C, MET131C, MET50A, PHE100C, PHE115C, PHE49A, PHE51A, PRO130A, PRO134A, PRO90C, SER-6A, SER109C, SER124C, SER127C, SER2A, SER33A, THR34A, THR91C, THR98C, TRP132C, TRP141A, TYR110C, TYR140A, VAL123C, VAL130C, VAL133C, VAL28A, VAL31A, VAL6A
• B-C: ALA101C, ALA103B, ALA37B, ARG122C, ARG126C, ASN107C, ASN128C, ASN66B, ASP102C, ASP72B, CYS104C, CYS108C, CYS111C, GLN102B, GLN112C, GLU32B, GLU63B, GLY103C, GLY105C, GLY68B, GLY76B, HIS106C, ILE110B, ILE36B, ILE70B, LEU125C, LEU69B, LYS114C, LYS129C, LYS27B, LYS67B, MET105B, MET131C, MET74B, SER101B, SER109C, SER124C, SER127C, THR25B, THR34B, THR35B, THR73B, THR77B, TRP132C, TRP65B, TRP71B, TYR110C, TYR23B, VAL123C, VAL130C, VAL133C, VAL38B, VAL75B