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Session Map (id=192-9P-NM9)

Interfaces in PDB 5llh crystal.
Space symmetry group: P 1 21 1. Resolution: 1.90 Å

CRYSTAL STRUCTURE OF HUMAN CARBONIC ANHYDRASE ISOZYME II WITH 4-(1,3- BENZOTHIAZOL-2-YLTHIO)-2,3,5,6-TETRA UOROBENZENESULFONAMIDE

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	`56`	`19`	`11672`	`x`	A	x-1,y,z	`1_455`	`40`	`8`	`11672`	`428.5`	`-1.8`	`0.476`	`3`	`4`	`0`	`0.000`
`2`		A	`46`	`13`	`11672`	`x`	A	-x,y-1/2,-z+1	`2_546`	`46`	`17`	`11672`	`393.0`	`0.9`	`0.708`	`2`	`0`	`0`	`0.000`
`3`		A	`37`	`11`	`11672`	`x`	A	-x-1,y-1/2,-z	`2_445`	`32`	`11`	`11672`	`340.5`	`-1.1`	`0.482`	`3`	`1`	`0`	`0.000`
`4`		[V49]A:302	`24`	`1`	`513`	`f`	A	x,y,z	`1_555`	`42`	`19`	`11672`	`314.9`	`1.6`	`0.247`	`4`	`0`	`0`	`0.000`
`5`		A	`36`	`10`	`11672`	`x`	A	x,y-1,z	`1_545`	`34`	`10`	`11672`	`311.6`	`-0.3`	`0.603`	`4`	`0`	`0`	`0.000`
`6`		A	`32`	`11`	`11672`	`x`	A	-x,y-1/2,-z	`2_545`	`39`	`14`	`11672`	`301.4`	`-1.8`	`0.223`	`3`	`1`	`0`	`0.000`
`7`		[MES]A:305	`7`	`1`	`254`	`◊`	A	x,y,z	`1_555`	`29`	`8`	`11672`	`169.9`	`6.3`	`0.423`	`0`	`0`	`0`	`0.000`
`8`		[BCN]A:306	`9`	`1`	`311`	`f`	A	x,y,z	`1_555`	`18`	`6`	`11672`	`117.0`	`-0.0`	`0.530`	`1`	`0`	`0`	`0.001`
`9`		[DMS]A:304	`4`	`1`	`207`	`f`	A	x,y,z	`1_555`	`16`	`6`	`11672`	`115.3`	`2.5`	`0.447`	`0`	`0`	`0`	`0.000`
`10`		[DMS]A:303	`4`	`1`	`206`	`f`	A	x,y,z	`1_555`	`12`	`5`	`11672`	`102.0`	`2.5`	`0.419`	`1`	`0`	`0`	`0.000`
`11`		[DMS]A:303	`4`	`1`	`206`	`f`	[V49]A:302	x,y,z	`1_555`	`7`	`1`	`513`	`53.9`	`-0.4`	`0.147`	`0`	`0`	`0`	`0.001`
`12`		[ZN]A:301	`1`	`1`	`98`	`f`	A	x,y,z	`1_555`	`7`	`5`	`11672`	`35.6`	`-25.7`	`0.000`	`0`	`0`	`0`	`0.073`
`13`		[V49]A:302	`5`	`1`	`513`	`f`	[ZN]A:301	x,y,z	`1_555`	`1`	`1`	`98`	`30.6`	`-13.3`	`0.000`	`0`	`0`	`0`	`0.038`
`14`		[MES]A:305	`1`	`1`	`254`	`f`	A	-x-1,y-1/2,-z	`2_445`	`2`	`1`	`11672`	`8.4`	`0.4`	`0.466`	`0`	`0`	`0`	`0.000`
`15`		A	`3`	`2`	`11672`	`◊`	[DMS]A:303	-x,y-1/2,-z	`2_545`	`1`	`1`	`206`	`3.1`	`0.1`	`0.391`	`0`	`0`	`0`	`0.000`

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