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PISA Interface List.

Session Map (id=635-H3-5FD)

Interfaces in PDB 5tpg crystal.
Space symmetry group: P 1 21 1. Resolution: 1.50 Å

OPTIMIZATION OF SPIROCYCLIC PROLINE TRYPTOPHANHYDROXYLASE-1 INHIBITORS

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`		[7H5]A:505	`41`	`1`	`801`	`f`	A	x,y,z	`1_555`	`85`	`26`	`11994`	`529.4`	`-0.2`	`0.573`	`8`	`0`	`0`	`0.031`
`2`		A	`33`	`6`	`11994`	`x`	A	x-1,y,z	`1_455`	`28`	`9`	`11994`	`274.1`	`-2.9`	`0.419`	`1`	`0`	`0`	`0.000`
`3`		A	`34`	`11`	`11994`	`x`	A	-x,y-1/2,-z	`2_545`	`23`	`6`	`11994`	`211.8`	`-0.8`	`0.647`	`1`	`1`	`0`	`0.000`
`4`		A	`19`	`6`	`11994`	`x`	A	-x+1,y-1/2,-z+1	`2_646`	`18`	`8`	`11994`	`157.6`	`-0.9`	`0.551`	`1`	`0`	`0`	`0.000`
`5`		[TRS]A:502	`7`	`1`	`255`	`f`	A	x,y,z	`1_555`	`25`	`10`	`11994`	`124.8`	`1.4`	`0.206`	`4`	`0`	`0`	`0.003`
`6`		A	`14`	`4`	`11994`	`x`	A	-x+1,y-1/2,-z	`2_645`	`14`	`5`	`11994`	`121.6`	`1.4`	`0.856`	`2`	`3`	`0`	`0.000`
`7`		[CCN]A:503	`3`	`1`	`177`	`f`	A	x,y,z	`1_555`	`15`	`8`	`11994`	`101.6`	`4.0`	`0.476`	`0`	`0`	`0`	`0.000`
`8`		[CCN]A:504	`3`	`1`	`176`	`◊`	A	x,y,z	`1_555`	`21`	`8`	`11994`	`99.7`	`2.9`	`0.426`	`0`	`0`	`0`	`0.000`
`9`		[7H5]A:505	`14`	`1`	`801`	`f`	[TRS]A:502	x,y,z	`1_555`	`5`	`1`	`255`	`62.9`	`1.6`	`0.613`	`0`	`0`	`0`	`0.000`
`10`		[FE]A:501	`1`	`1`	`137`	`f`	A	x,y,z	`1_555`	`12`	`8`	`11994`	`44.8`	`-8.1`	`0.000`	`0`	`0`	`0`	`0.066`
`11`		[TRS]A:502	`3`	`1`	`255`	`f`	[FE]A:501	x,y,z	`1_555`	`1`	`1`	`137`	`37.5`	`-4.1`	`0.000`	`0`	`0`	`0`	`0.033`
`12`		[CCN]A:504	`1`	`1`	`176`	`f`	A	-x,y-1/2,-z	`2_545`	`3`	`2`	`11994`	`30.3`	`0.8`	`0.447`	`0`	`0`	`0`	`0.000`
`13`		[7H5]A:505	`8`	`1`	`801`	`f`	[FE]A:501	x,y,z	`1_555`	`1`	`1`	`137`	`25.0`	`-2.2`	`0.000`	`0`	`0`	`0`	`0.018`

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