Protein Data Bank
in Europe

Bringing Structure to Biology

PDBePISA

pdbe.org/pisa

wwPDB

EMDataBank

PISA Interface List.

Session Map (id=789-C7-AA4)

Interfaces in PDB 2amd crystal.
Space symmetry group: P 1 21 1. Resolution: 1.85 Å

CRYSTAL STRUCTURE OF SARS_COV MPRO IN COMPLEX WITH AN INHIBITOR N9

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	`150`	`47`	`14221`	`◊`	A	x,y,z	`1_555`	`146`	`45`	`14388`	`1473.4`	`-11.1`	`0.305`	`28`	`6`	`0`	`0.834`
2	`2`		[9IN]A:1001	`41`	`1`	`915`	`cf`	A	x,y,z	`1_555`	`86`	`27`	`14388`	`586.7`	`1.5`	`0.341`	`10`	`0`	`0`	`0.170`
	`3`		[9IN]B:2001	`42`	`1`	`927`	`cf`	B	x,y,z	`1_555`	`86`	`28`	`14221`	`581.8`	`1.9`	`0.336`	`9`	`0`	`0`	`0.170`
	*Average:*													`584.2`	`1.7`	`0.338`	`10`	`0`	`0`	`0.170`
3	`4`		B	`64`	`26`	`14221`	`◊`	A	x-1,y,z	`1_455`	`57`	`19`	`14388`	`549.1`	`-5.4`	`0.308`	`2`	`4`	`0`	`0.000`
4	`5`		B	`41`	`9`	`14221`	`x`	B	x,y,z-1	`1_554`	`34`	`8`	`14221`	`348.7`	`-0.1`	`0.668`	`6`	`2`	`0`	`0.000`
5	`6`		B	`11`	`5`	`14221`	`◊`	A	-x+3,y-1/2,-z	`2_845`	`16`	`5`	`14388`	`153.9`	`-1.1`	`0.438`	`0`	`0`	`0`	`0.000`
6	`7`		[9IN]A:1001	`3`	`1`	`915`	`◊`	B	x,y,z	`1_555`	`5`	`3`	`14221`	`20.7`	`0.0`	`0.483`	`0`	`0`	`0`	`0.000`
7	`8`		[9IN]B:2001	`2`	`1`	`927`	`◊`	A	x,y,z	`1_555`	`3`	`3`	`14388`	`16.4`	`0.1`	`0.544`	`0`	`0`	`0`	`0.000`

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