PDBe < PISA < EMBL-EBI

PISA Interface List.

Session Map (id=877-L1-H4C)

Interfaces in PDB 7com crystal.
Space symmetry group: P 21 21 21. Resolution: 2.25 Å

CRYSTAL STRUCTURE OF THE SARS-COV-2 MAIN PROTEASE IN COMPLEX WITH BOCEPREVIR (SPACE GROUP P212121)

Interfaces

##			Structure 1				×	Structure 2						interface area, Å²	ΔⁱG kcal/mol	ΔⁱG P-value	N_HB	N_SB	N_DS	CSS
Id	NN	«»	Range	ⁱN_at	ⁱN_res	Surface Å²	×	Range	Symmetry op-n	Sym.ID	ⁱN_at	ⁱN_res	Surface Å²	interface area, Å²	ΔⁱG kcal/mol	ΔⁱG P-value	N_HB	N_SB	N_DS	CSS
1	`1`		B	`142`	`45`	`13987`	`◊`	A	x,y,z	`1_555`	`145`	`43`	`14060`	`1426.0`	`-11.8`	`0.254`	`34`	`9`	`0`	`0.543`
2	`2`		A	`73`	`25`	`14060`	`◊`	B	-x,y-1/2,-z+1/2	`3_545`	`81`	`25`	`13987`	`667.6`	`-2.5`	`0.588`	`9`	`6`	`0`	`0.000`
3	`3`		B	`64`	`21`	`13987`	`◊`	A	-x+1/2,-y,z-1/2	`2_554`	`56`	`15`	`14060`	`546.8`	`-0.5`	`0.689`	`12`	`0`	`0`	`0.000`
4	`4`		[U5G]A:401	`31`	`1`	`718`	`cf`	A	x,y,z	`1_555`	`74`	`24`	`14060`	`463.5`	`-6.9`	`0.447`	`8`	`0`	`0`	`0.457`
	`5`		[U5G]B:401	`32`	`1`	`732`	`cf`	B	x,y,z	`1_555`	`68`	`24`	`13987`	`459.3`	`-8.9`	`0.357`	`10`	`0`	`0`	`0.457`
	*Average:*													`461.4`	`-7.9`	`0.402`	`9`	`0`	`0`	`0.457`
5	`6`		A	`39`	`9`	`14060`	`x`	A	x-1,y,z	`1_455`	`42`	`9`	`14060`	`357.5`	`0.0`	`0.695`	`6`	`4`	`0`	`0.000`
6	`7`		B	`40`	`16`	`13987`	`◊`	A	-x-1/2,-y,z-1/2	`2_454`	`35`	`15`	`14060`	`354.8`	`2.4`	`0.816`	`9`	`0`	`0`	`0.000`
7	`8`		A	`25`	`11`	`14060`	`◊`	B	x-1/2,-y-1/2,-z	`4_445`	`23`	`5`	`13987`	`214.2`	`-0.2`	`0.635`	`3`	`4`	`0`	`0.000`
8	`9`		B	`11`	`4`	`13987`	`x`	B	-x+1/2,-y,z-1/2	`2_554`	`9`	`2`	`13987`	`77.4`	`0.4`	`0.568`	`0`	`0`	`0`	`0.000`
9	`10`		[U5G]B:401	`2`	`1`	`732`	`◊`	A	x,y,z	`1_555`	`1`	`1`	`14060`	`3.4`	`-0.0`	`0.712`	`0`	`0`	`0`	`0.000`

PDBe PISA v1.52 [20/10/2014]

Protein Data Bank
in Europe