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Session Map (id=454-0C-OJ5)

Interfaces in PDB 1jvs crystal.
Space symmetry group: P 21 21 2. Resolution: 2.20 Å

CRYSTAL STRUCTURE OF 1-DEOXY-D-XYLULOSE 5-PHOSPHATE REDUCTOISOMERASE; A TARGET ENZYME FOR ANTIMALARIAL DRUGS

Interfaces

##			Structure 1				×	Structure 2						interface area, Å²	ΔⁱG kcal/mol	ΔⁱG P-value	N_HB	N_SB	N_DS	CSS
Id	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	`1`		B	`175`	`49`	`17257`	`◊`	A	x,y,z	`1_555`	`182`	`51`	`17334`	`1597.0`	`-18.9`	`0.049`	`25`	`7`	`0`	`0.318`
2	`2`		A	`71`	`18`	`17334`	`◊`	B	-x+1/2,y-1/2,-z+1	`3_546`	`67`	`18`	`17257`	`600.7`	`0.5`	`0.681`	`12`	`3`	`0`	`0.000`
3	`3`		[NDP]A:2001	`47`	`1`	`898`	`f`	A	x,y,z	`1_555`	`74`	`28`	`17334`	`572.9`	`-5.7`	`0.228`	`11`	`0`	`0`	`0.222`
	`4`		[NDP]B:2002	`46`	`1`	`909`	`f`	B	x,y,z	`1_555`	`72`	`26`	`17257`	`570.6`	`-4.9`	`0.320`	`14`	`0`	`0`	`0.222`
	*Average:*													`571.8`	`-5.3`	`0.274`	`13`	`0`	`0`	`0.222`
4	`5`		B	`48`	`16`	`17257`	`◊`	A	x,y,z-1	`1_554`	`49`	`17`	`17334`	`441.8`	`-1.7`	`0.479`	`2`	`3`	`0`	`0.000`
5	`6`		A	`42`	`11`	`17334`	`x`	A	x,y-1,z	`1_545`	`45`	`15`	`17334`	`401.3`	`1.2`	`0.699`	`3`	`3`	`0`	`0.000`
6	`7`		A	`24`	`8`	`17334`	`◊`	A	-x,-y+2,z	`2_575`	`24`	`8`	`17334`	`266.8`	`1.4`	`0.756`	`4`	`8`	`0`	`0.000`
	`8`		B	`23`	`8`	`17257`	`◊`	B	-x,-y+2,z	`2_575`	`23`	`8`	`17257`	`243.0`	`2.5`	`0.858`	`8`	`6`	`0`	`0.000`
	*Average:*													`254.9`	`2.0`	`0.807`	`6`	`7`	`0`	`0.000`
7	`9`		[SO4]A:1001	`5`	`1`	`185`	`f`	A	x,y,z	`1_555`	`21`	`11`	`17334`	`123.8`	`-20.3`	`0.563`	`7`	`0`	`0`	`0.239`
8	`10`		[SO4]B:1002	`5`	`1`	`185`	`f`	B	x,y,z	`1_555`	`20`	`10`	`17257`	`119.5`	`-18.1`	`0.733`	`8`	`0`	`0`	`0.221`
9	`11`		A	`3`	`3`	`17334`	`◊`	A	-x,-y+1,z	`2_565`	`3`	`3`	`17334`	`39.6`	`1.3`	`0.921`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
in Europe