PDBe < PISA < EMBL-EBI

PISA Interface List.

Session Map (id=466-71-PD4)

Interfaces in PDB 2ca2 crystal.
Space symmetry group: P 1 21 1. Resolution: 1.90 Å

CRYSTALLOGRAPHIC STUDIES OF INHIBITOR BINDING SITES IN HUMAN CARBONIC ANHYDRASE II. A PENTACOORDINATED BINDING OF THE SCN-ION TO THE ZINC AT HIGH P*H

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	`43`	`15`	`11535`	`x`	A	x-1,y,z	`1_455`	`34`	`8`	`11535`	`360.6`	`-0.4`	`0.602`	`4`	`2`	`0`	`0.000`
`2`		A	`30`	`10`	`11535`	`x`	A	-x,y-1/2,-z+1	`2_546`	`39`	`16`	`11535`	`308.8`	`-0.3`	`0.591`	`1`	`0`	`0`	`0.000`
`3`		A	`33`	`10`	`11535`	`x`	A	-x-1,y-1/2,-z	`2_445`	`32`	`11`	`11535`	`305.4`	`0.7`	`0.641`	`3`	`2`	`0`	`0.000`
`4`		A	`39`	`11`	`11535`	`x`	A	x,y-1,z	`1_545`	`29`	`9`	`11535`	`286.1`	`-0.7`	`0.509`	`2`	`0`	`0`	`0.000`
`5`		A	`31`	`10`	`11535`	`x`	A	-x,y-1/2,-z	`2_545`	`35`	`14`	`11535`	`258.8`	`-1.1`	`0.410`	`3`	`1`	`0`	`0.000`
`6`		[SCN]A:263	`3`	`1`	`180`	`f`	A	x,y,z	`1_555`	`18`	`9`	`11535`	`101.0`	`-3.1`	`0.411`	`0`	`0`	`0`	`0.005`
`7`		[HG]A:262	`1`	`1`	`137`	`f`	A	x,y,z	`1_555`	`16`	`7`	`11535`	`71.5`	`-23.5`	`0.000`	`0`	`0`	`0`	`0.036`
`8`		[ZN]A:264	`1`	`1`	`98`	`f`	A	x,y,z	`1_555`	`6`	`5`	`11535`	`38.3`	`-27.3`	`0.000`	`0`	`0`	`0`	`0.042`
`9`		[ZN]A:264	`1`	`1`	`98`	`f`	[SCN]A:263	x,y,z	`1_555`	`1`	`1`	`180`	`28.8`	`-11.3`	`0.000`	`0`	`0`	`0`	`0.017`

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

Protein Data Bank
in Europe