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Session Map (id=961-H2-5BA)

Interfaces in PDB 5e88 crystal.
Space symmetry group: P 21 21 21. Resolution: 1.60 Å

CRYSTAL STRUCTURE OF HUMAN GALECTIN-3 CRD IN COMPLEX WITH THIENYL-1,2, 3-TRIAZOLYL THIODIGALACTOSIDE INHIBITOR

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	`47`	`13`	`7276`	`x`	A	-x+1/2,-y,z-1/2	`2_554`	`42`	`14`	`7276`	`393.4`	`-0.5`	`0.439`	`3`	`0`	`0`	`0.000`
`2`		A	`35`	`9`	`7276`	`x`	A	-x+1,y-1/2,-z+1/2	`3_645`	`41`	`13`	`7276`	`365.0`	`2.7`	`0.705`	`4`	`2`	`0`	`0.000`
`3`		[5KT]A:302	`31`	`1`	`841`	`f`	A	x,y,z	`1_555`	`46`	`15`	`7276`	`347.8`	`-3.8`	`0.573`	`7`	`0`	`0`	`0.045`
`4`		A	`37`	`13`	`7276`	`x`	A	x-1/2,-y+1/2,-z	`4_455`	`33`	`9`	`7276`	`343.2`	`-2.4`	`0.242`	`5`	`0`	`0`	`0.000`
`5`		A	`7`	`3`	`7276`	`x`	A	x-1,y,z	`1_455`	`9`	`2`	`7276`	`63.9`	`-0.5`	`0.353`	`0`	`0`	`0`	`0.000`
`6`		[CL]A:301	`1`	`1`	`125`	`f`	A	x,y,z	`1_555`	`15`	`5`	`7276`	`61.3`	`-8.5`	`0.000`	`0`	`0`	`0`	`0.055`
`7`		A	`7`	`2`	`7276`	`◊`	[5KT]A:302	x-1,y,z	`1_455`	`7`	`1`	`841`	`58.0`	`-2.0`	`0.278`	`0`	`0`	`0`	`0.000`
`8`		A	`7`	`3`	`7276`	`◊`	[CL]A:301	x-1/2,-y+1/2,-z	`4_455`	`1`	`1`	`125`	`37.6`	`-4.4`	`0.000`	`0`	`0`	`0`	`0.000`
`9`		A	`4`	`3`	`7276`	`◊`	[5KT]A:302	x-1/2,-y-1/2,-z	`4_445`	`5`	`1`	`841`	`26.4`	`0.2`	`0.719`	`0`	`0`	`0`	`0.000`
`10`		A	`1`	`1`	`7276`	`x`	A	x-1/2,-y-1/2,-z	`4_445`	`1`	`1`	`7276`	`3.9`	`0.1`	`0.763`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
in Europe