PDBe < PISA < EMBL-EBI

PISA Interface List.

Session Map (id=541-44-P3C)

Interfaces in PDB 2c3l crystal.
Space symmetry group: P 1 21 1. Resolution: 2.35 Å

IDENTIFICATION OF A BURIED POCKET FOR POTENT AND SELECTIVE INHIBITION OF CHK1: PREDICTION AND VERIFICATION

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	`59`	`23`	`13607`	`x`	A	-x+1,y-1/2,-z+1	`2_646`	`53`	`18`	`13607`	`479.3`	`-4.5`	`0.265`	`4`	`0`	`0`	`0.000`
`2`		A	`43`	`10`	`13607`	`x`	A	x-1,y,z	`1_455`	`47`	`14`	`13607`	`400.2`	`-0.6`	`0.580`	`2`	`1`	`0`	`0.000`
`3`		A	`28`	`7`	`13607`	`x`	A	x,y,z-1	`1_554`	`31`	`10`	`13607`	`306.2`	`0.2`	`0.650`	`5`	`4`	`0`	`0.000`
`4`		[IDZ]A:1274	`18`	`1`	`404`	`f`	A	x,y,z	`1_555`	`34`	`16`	`13607`	`267.3`	`3.7`	`0.381`	`2`	`0`	`0`	`0.000`
`5`		[SO4]A:1275	`5`	`1`	`185`	`f`	A	x,y,z	`1_555`	`12`	`7`	`13607`	`88.1`	`-12.4`	`0.875`	`4`	`0`	`0`	`0.124`
`6`		A	`5`	`2`	`13607`	`x`	A	-x,y-1/2,-z	`2_545`	`2`	`1`	`13607`	`29.1`	`-0.3`	`0.316`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
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