3MDJ

er aminopeptidase, erap1, bound to the zinc aminopeptidase inhibitor, bestatin

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 64
  • Norm. En. per Res.: -2.0055
• 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	-34.9326	-15.4423	-77.9786	-128.3535	64	16	3	4825	2	22	24
A-C	-15.4746	-22.4529	-88.3009	-126.2284	77	2	2	5002	2	27	29
B-C	-24.0698	-9.6845	-109.77	-143.5243	75	12	2	5399	3	35	35

Interface residues

• A-B: ALA201B, ARG538A, ARG540A, ASN541A, ASP237B, ASP558A, ASP587A, ASP614A, GLU547A, GLU593A, GLU594A, GLU613A, GLU83B, GLY142B, GLY539A, HIS543A, HIS62B, ILE590A, ILE59B, LEU143B, LEU303B, LEU363B, LEU589A, LEU591A, LYS200B, LYS241B, LYS305B, LYS467B, LYS471B, LYS545A, LYS583A, LYS585A, LYS651A, MET219B, MET242B, PHE203B, PHE580A, PRO144B, PRO300B, PRO302B, PRO304B, PRO592A, PRO60B, SER202B, SER204B, SER469B, SER87B, THR146B, THR239B, THR534A, THR536A, THR586A, THR85B, TRP322B, TYR301B, TYR470B, TYR63B, VAL141B, VAL238B, VAL240B, VAL537A, VAL542A, VAL588A, VAL61B
• A-C: ALA201A, ALA86A, ARG114A, ARG538C, ARG540C, ASN541C, ASP237A, ASP558C, ASP587C, ASP614C, ASP64A, GLN546C, GLU547C, GLU593C, GLU594C, GLU613C, GLU83A, GLY110A, GLY142A, GLY539C, GLY560C, GLY650C, HIS543C, HIS611C, HIS62A, ILE590C, ILE59A, LEU140A, LEU143A, LEU303A, LEU363A, LEU581C, LEU589C, LEU591C, LEU652C, LYS200A, LYS241A, LYS305A, LYS471A, LYS545C, LYS583C, LYS585C, LYS651C, MET219A, MET242A, PHE203A, PHE580C, PRO144A, PRO220A, PRO300A, PRO302A, PRO304A, PRO557C, PRO592C, PRO60A, SER202A, SER204A, SER469A, SER653C, SER87A, THR146A, THR239A, THR534C, THR536C, THR586C, THR85A, TRP322A, TYR301A, TYR470A, VAL141A, VAL222A, VAL238A, VAL240A, VAL537C, VAL542C, VAL588C, VAL61A
• B-C: ALA201C, ALA86C, ARG114C, ARG538B, ARG540B, ASN541B, ASP237C, ASP558B, ASP587B, ASP614B, ASP64C, GLN546B, GLU113C, GLU547B, GLU593B, GLU594B, GLU613B, GLU655B, GLU83C, GLY142C, GLY539B, HIS543B, HIS62C, ILE590B, ILE59C, LEU140C, LEU143C, LEU303C, LEU363C, LEU589B, LEU591B, LYS200C, LYS241C, LYS305C, LYS471C, LYS545B, LYS585B, LYS651B, LYS656B, LYS924B, LYS928B, MET219C, MET242C, PHE203C, PHE580B, PRO144C, PRO220C, PRO300C, PRO302C, PRO304C, PRO592B, PRO60C, SER202C, SER204C, SER469C, SER653B, SER87C, THR146C, THR239C, THR534B, THR536B, THR586B, THR85C, TRP322C, TYR301C, TYR470C, TYR63C, VAL141C, VAL222C, VAL238C, VAL240C, VAL537B, VAL542B, VAL588B, VAL61C