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Interfaces in PDB 2w3i crystal.
Space symmetry group: P 21 21 21. Resolution: 1.90 Å

CRYSTAL STRUCTURE OF FXA IN COMPLEX WITH 4,4-DISUBSTITUTED PYRROLIDINE-1,2-DICARBOXAMIDE INHIBITOR 2

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`		B	`97`	`23`	`4118`	`◊`	A	x,y,z	`1_555`	`100`	`30`	`11224`	`869.5`	`-9.5`	`0.062`	`12`	`2`	`1`	`0.586`
`2`		[L1C]A:1246	`38`	`1`	`795`	`f`	A	x,y,z	`1_555`	`77`	`25`	`11224`	`503.4`	`0.4`	`0.358`	`4`	`0`	`0`	`0.042`
`3`		A	`44`	`15`	`11224`	`◊`	B	x-1/2,-y+1/2,-z+1	`4_456`	`39`	`13`	`4118`	`445.7`	`2.2`	`0.798`	`11`	`8`	`0`	`0.000`
`4`		A	`34`	`13`	`11224`	`x`	A	-x+1,y-1/2,-z+1/2	`3_645`	`41`	`17`	`11224`	`377.3`	`1.9`	`0.550`	`4`	`3`	`0`	`0.000`
`5`		A	`19`	`5`	`11224`	`◊`	B	x-1,y,z	`1_455`	`27`	`10`	`4118`	`212.5`	`1.7`	`0.802`	`0`	`5`	`0`	`0.000`
`6`		B	`23`	`7`	`4118`	`◊`	A	-x+1,y-1/2,-z+1/2	`3_645`	`16`	`7`	`11224`	`176.8`	`3.2`	`0.870`	`6`	`3`	`0`	`0.000`
`7`		A	`14`	`7`	`11224`	`◊`	B	-x+1,y-1/2,-z+1/2	`3_645`	`12`	`5`	`4118`	`90.7`	`-0.8`	`0.473`	`0`	`0`	`0`	`0.000`
`8`		A	`16`	`6`	`11224`	`x`	A	x-1/2,-y+1/2,-z+1	`4_456`	`7`	`2`	`11224`	`85.6`	`1.8`	`0.810`	`1`	`2`	`0`	`0.000`
`9`		[CA]A:1245	`1`	`1`	`85`	`f`	A	x,y,z	`1_555`	`10`	`7`	`11224`	`44.1`	`-12.2`	`0.000`	`0`	`0`	`0`	`0.373`
`10`		A	`3`	`2`	`11224`	`x`	A	-x+1/2,-y,z-1/2	`2_554`	`3`	`1`	`11224`	`15.9`	`-0.0`	`0.541`	`0`	`0`	`0`	`0.000`
`11`		[L1C]A:1246	`2`	`1`	`795`	`◊`	B	x-1,y,z	`1_455`	`1`	`1`	`4118`	`6.7`	`-0.0`	`0.478`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
in Europe