PDBe < PISA < EMBL-EBI

PISA Interface List.

Session Map (id=791-DH-071)

Interfaces in PDB 6y2f crystal.
Space symmetry group: C 1 2 1. Resolution: 1.95 Å

CRYSTAL STRUCTURE (MONOCLINIC FORM) OF THE COMPLEX RESULTING FROM THE REACTION BETWEEN SARS-COV-2 (2019-NCOV) MAIN PROTEASE AND TERT-BUTYL (1-((S)-1-(((S)-4-(BENZYLAMINO)-3,4-DIOXO-1-((S)-2-OXOPYRROLIDIN-3- YL)BUTAN-2-YL)AMINO)-3-CYCLOPROPYL-1-OXOPROPAN-2-YL)-2-OXO-1,2- DIHYDROPYRIDIN-3-YL)CARBAMATE (ALPHA-KETOAMIDE 13B)

Interfaces

##		Structure 1				×	Structure 2						interface area, Å²	ΔⁱG kcal/mol	ΔⁱG P-value	N_HB	N_SB	N_DS	CSS
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`		A	`154`	`47`	`14058`	`◊`	A	-x,y,-z	`2_555`	`152`	`47`	`14058`	`1553.9`	`-12.5`	`0.315`	`37`	`10`	`0`	`0.509`
`2`		A	`77`	`28`	`14058`	`◊`	A	-x,y,-z+1	`2_556`	`77`	`28`	`14058`	`612.6`	`0.0`	`0.804`	`12`	`0`	`0`	`0.000`
`3`		[O6K]A:502	`37`	`1`	`878`	`cf`	A	x,y,z	`1_555`	`72`	`21`	`14058`	`488.0`	`-12.4`	`0.326`	`11`	`0`	`0`	`0.579`
`4`		A	`41`	`12`	`14058`	`x`	A	x-1/2,y-1/2,z-1	`3_444`	`33`	`8`	`14058`	`337.7`	`-0.9`	`0.638`	`4`	`2`	`0`	`0.000`
`5`		[DMS]A:501	`4`	`1`	`208`	`f`	A	x,y,z	`1_555`	`23`	`10`	`14058`	`108.5`	`2.4`	`0.497`	`2`	`0`	`0`	`0.000`
`6`		[O6K]A:502	`14`	`1`	`878`	`f`	[DMS]A:501	x,y,z	`1_555`	`3`	`1`	`208`	`61.4`	`0.8`	`0.437`	`0`	`0`	`0`	`0.000`
`7`		A	`3`	`1`	`14058`	`x`	A	-x-1/2,y-1/2,-z	`4_445`	`3`	`1`	`14058`	`23.4`	`-0.2`	`0.474`	`0`	`0`	`0`	`0.000`
`8`		[O6K]A:502	`2`	`1`	`878`	`◊`	A	-x,y,-z	`2_555`	`1`	`1`	`14058`	`19.5`	`0.3`	`0.848`	`0`	`0`	`0`	`0.000`
`9`		A	`3`	`1`	`14058`	`x`	A	x-1/2,y-1/2,z	`3_445`	`1`	`1`	`14058`	`4.4`	`0.1`	`0.718`	`0`	`0`	`0`	`0.000`

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

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PDBePISA

Protein Data Bank in Europe

Bringing Structure to Biology

PDBePISA

Protein Data Bank
in Europe