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Interfaces in PDB 5jal crystal.
Space symmetry group: C 1 2 1. Resolution: 2.06 Å

EXPLOITATION OF A NOVEL BINDING POCKET IN HUMAN LIPOPROTEIN-ASSOCIATED PHOSPHOLIPASE A2 (LP-PLA₂) DISCOVERED THROUGH X-RAY FRAGMENT SCREENING

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	`76`	`22`	`15674`	`◊`	A	-x+1,y,-z	`2_655`	`76`	`22`	`15674`	`624.6`	`5.1`	`0.908`	`6`	`6`	`0`	`0.000`
`2`		A	`48`	`15`	`15674`	`x`	A	-x+1/2,y-1/2,-z	`4_545`	`36`	`10`	`15674`	`380.5`	`-1.5`	`0.429`	`5`	`0`	`0`	`0.000`
`3`		A	`30`	`12`	`15674`	`x`	A	x,y,z-1	`1_554`	`31`	`11`	`15674`	`280.5`	`1.9`	`0.791`	`5`	`3`	`0`	`0.000`
`4`		[6HO]A:505	`14`	`1`	`356`	`f`	A	x,y,z	`1_555`	`31`	`12`	`15674`	`262.0`	`0.3`	`0.211`	`0`	`0`	`0`	`0.000`
`5`		A	`20`	`8`	`15674`	`◊`	A	-x+1,y,-z+1	`2_656`	`20`	`8`	`15674`	`155.8`	`1.0`	`0.735`	`0`	`0`	`0`	`0.000`
`6`		[DMS]A:504	`4`	`1`	`204`	`◊`	A	x,y,z	`1_555`	`18`	`5`	`15674`	`110.2`	`2.8`	`0.409`	`0`	`0`	`0`	`0.000`
`7`		[CL]A:502	`1`	`1`	`125`	`f`	A	x,y,z	`1_555`	`11`	`5`	`15674`	`72.7`	`-11.3`	`0.000`	`0`	`0`	`0`	`0.066`
`8`		[CL]A:503	`1`	`1`	`125`	`f`	A	-x+1/2,y-1/2,-z	`4_545`	`12`	`4`	`15674`	`52.7`	`-6.7`	`0.000`	`0`	`0`	`0`	`0.040`
`9`		[CL]A:503	`1`	`1`	`125`	`◊`	A	x,y,z	`1_555`	`7`	`3`	`15674`	`47.0`	`-6.6`	`0.000`	`0`	`0`	`0`	`0.000`
`10`		[MG]A:501	`1`	`1`	`98`	`x`	A	x,y,z	`1_555`	`9`	`4`	`15674`	`43.2`	`-5.4`	`0.000`	`0`	`0`	`0`	`0.000`
`11`		A	`1`	`1`	`15674`	`◊`	A	-x,y,-z-1	`2_554`	`1`	`1`	`15674`	`22.3`	`-0.7`	`0.090`	`0`	`0`	`0`	`0.000`
`12`		[DMS]A:504	`2`	`1`	`204`	`f`	A	-x+1/2,y-1/2,-z	`4_545`	`1`	`1`	`15674`	`14.4`	`0.7`	`0.628`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
in Europe