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Interfaces in PDB 3w0j crystal.
Space symmetry group: C 1 2 1. Resolution: 1.84 Å

CRYSTAL STRUCTURE OF RAT VDR LIGAND BINDING DOMAIN IN COMPLEX WITH NOVEL NONSECOSTEROIDAL LIGANDS

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`		[T08]A:501	`29`	`1`	`709`	`f`	A	x,y,z	`1_555`	`68`	`31`	`12040`	`529.4`	`1.0`	`0.157`	`5`	`0`	`0`	`0.100`
`2`		C	`42`	`10`	`1418`	`◊`	A	x,y,z	`1_555`	`50`	`13`	`12040`	`506.9`	`-9.8`	`0.348`	`4`	`0`	`0`	`0.904`
`3`		A	`50`	`17`	`12040`	`◊`	A	-x,y,-z+1	`2_556`	`50`	`17`	`12040`	`425.2`	`-8.5`	`0.094`	`0`	`0`	`0`	`0.189`
`4`		A	`46`	`17`	`12040`	`x`	A	-x+1/2,y-1/2,-z+1	`4_546`	`40`	`12`	`12040`	`365.0`	`-2.4`	`0.501`	`2`	`1`	`0`	`0.000`
`5`		A	`35`	`10`	`12040`	`x`	A	x,y,z-1	`1_554`	`33`	`9`	`12040`	`307.7`	`-0.3`	`0.690`	`5`	`5`	`0`	`0.000`
`6`		C	`17`	`4`	`1418`	`◊`	A	-x,y,-z+1	`2_556`	`23`	`7`	`12040`	`200.6`	`-5.4`	`0.164`	`0`	`0`	`0`	`0.239`
`7`		A	`10`	`4`	`12040`	`x`	A	x,y-1,z	`1_545`	`11`	`4`	`12040`	`71.2`	`-0.8`	`0.524`	`0`	`0`	`0`	`0.000`
`8`		C	`4`	`1`	`1418`	`◊`	A	x,y,z-1	`1_554`	`4`	`1`	`12040`	`35.6`	`0.0`	`0.618`	`1`	`0`	`0`	`0.000`

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

Protein Data Bank
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