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Interfaces in PDB 1g9b crystal.
Space symmetry group: P 1 21 1. Resolution: 2.00 Å

CRYSTAL STRUCTURE OF CLOSTRIDIUM BOTULINUM NEUROTOXIN B COMPLEXED WITH AN INHIBITOR (EXPERIMENT 1)

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	`102`	`26`	`54075`	`x`	A	-x+1,y-1/2,-z+1	`2_646`	`88`	`25`	`54075`	`913.3`	`4.1`	`0.829`	`18`	`8`	`0`	`0.000`
`2`		A	`69`	`18`	`54075`	`x`	A	-x+1,y-1/2,-z	`2_645`	`62`	`20`	`54075`	`588.7`	`2.0`	`0.749`	`11`	`6`	`0`	`0.000`
`3`		A	`67`	`20`	`54075`	`x`	A	x,y,z-1	`1_554`	`61`	`20`	`54075`	`548.9`	`1.0`	`0.563`	`7`	`0`	`0`	`0.000`
`4`		[BAB]A:1293	`25`	`1`	`576`	`f`	A	x,y,z	`1_555`	`57`	`21`	`54075`	`397.5`	`7.7`	`0.307`	`3`	`0`	`0`	`0.000`
`5`		[BAB]A:1292	`25`	`1`	`583`	`f`	A	x,y,z	`1_555`	`54`	`18`	`54075`	`372.2`	`9.8`	`0.473`	`6`	`0`	`0`	`0.000`
`6`		A	`33`	`9`	`54075`	`x`	A	x-1,y,z-1	`1_454`	`50`	`18`	`54075`	`339.7`	`0.7`	`0.640`	`2`	`1`	`0`	`0.000`
`7`		A	`37`	`8`	`54075`	`x`	A	-x,y-1/2,-z-1	`2_544`	`36`	`14`	`54075`	`298.2`	`1.2`	`0.695`	`5`	`2`	`0`	`0.000`
`8`		A	`29`	`9`	`54075`	`x`	A	-x,y-1/2,-z	`2_545`	`25`	`7`	`54075`	`217.2`	`-1.0`	`0.392`	`1`	`0`	`0`	`0.000`
`9`		[ZN]A:1291	`1`	`1`	`98`	`f`	A	x,y,z	`1_555`	`12`	`5`	`54075`	`50.5`	`-29.1`	`0.000`	`0`	`0`	`0`	`0.054`
`10`		[ZN]A:1294	`1`	`1`	`98`	`f`	A	x,y,z	`1_555`	`13`	`6`	`54075`	`41.2`	`-20.4`	`0.000`	`0`	`0`	`0`	`0.038`
`11`		[BAB]A:1292	`8`	`1`	`583`	`f`	[ZN]A:1294	x,y,z	`1_555`	`1`	`1`	`98`	`35.6`	`-18.2`	`0.000`	`0`	`0`	`0`	`0.034`
`12`		[BAB]A:1293	`2`	`1`	`576`	`f`	[BAB]A:1292	x,y,z	`1_555`	`2`	`1`	`583`	`2.2`	`0.1`	`0.056`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
in Europe