3M0C

the x-ray crystal structure of pcsk9 in complex with the ldl receptor

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 127
  • Norm. En. per Res.: -3.7453
• 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	-129.5707	-22.8961	-323.181	-475.6478	127	22	16	13793	1	17	15
A-C	0.0	0.0	-0.6132	-0.6132	5	0	0	103	0	2	1
B-C	-25.7812	16.0598	-52.3343	-62.0557	58	40	5	5873	0	10	13

Interface residues

• A-B: ALA151A, ALA290B, ALA299B, ALA300B, ALA305B, ALA307B, ALA314B, ALA315B, ALA328B, ALA338B, ALA388B, ALA389B, ALA62A, ALA68A, ARG272B, ARG295B, ARG303B, ARG306B, ARG319B, ARG66A, ASN207B, ASN254B, ASN298B, ASN317B, ASN354B, ASP141A, ASP146A, ASP186B, ASP212B, ASP320B, ASP321B, CYS301B, CYS67A, GLN152A, GLN256B, GLN302B, GLN382B, GLN387B, GLU144A, GLU145A, GLU269B, GLU84A, GLU85A, GLY117A, GLY121A, GLY227B, GLY257B, GLY259B, GLY263B, GLY267B, GLY291B, GLY292B, GLY316B, GLY352B, GLY384B, HIS113A, HIS116A, HIS226B, HIS65A, ILE143A, ILE266B, ILE271B, LEU112A, LEU118A, LEU119A, LEU123A, LEU185B, LEU230B, LEU253B, LEU265B, LEU268B, LEU276B, LEU287B, LEU289B, LEU297B, LEU304B, LEU311B, LEU324B, LEU348B, LEU351B, LEU74A, LEU88A, LYS258B, LYS273B, LYS69A, PHE115A, PHE150A, PHE205B, PHE270B, PHE318B, PHE64A, PRO120A, PRO209B, PRO288B, PRO327B, PRO71A, SER147A, SER148A, SER262B, SER294B, SER326B, SER383B, SER386B, THR187B, THR260B, THR264B, THR313B, THR353B, THR385B, THR61A, THR63A, THR77A, TRP72A, TYR142A, TYR293B, TYR325B, TYR78A, VAL114A, VAL149A, VAL252B, VAL261B, VAL296B, VAL309B, VAL336B, VAL79A, VAL80A, VAL81A
• A-C: ARG385C, GLY106A, HIS386C, LEU108A, LEU626C
• B-C: ALA220B, ALA239B, ALA371B, ARG194B, ARG237B, ASN295C, ASN300C, ASN301C, ASN309C, ASP238B, ASP299C, ASP310C, ASP321C, ASP367B, CYS297C, CYS304C, CYS308C, CYS317C, CYS319C, CYS375B, CYS378B, GLU195B, GLU296C, GLU316C, GLY240B, GLY293C, GLY302C, GLY303C, GLY322C, GLY370B, HIS193B, HIS306C, ILE154B, ILE369B, LEU158B, LEU298C, LEU311C, LEU318C, LYS222B, LYS243B, LYS312C, PHE323C, PHE379B, PRO155B, PRO320C, SER153B, SER221B, SER305C, SER372B, SER373B, SER376B, SER381B, THR294C, THR377B, TRP156B, TYR374B, VAL307C, VAL380B