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Interfaces in PDB 4wki crystal.
Space symmetry group: P 21 21 21. Resolution: 1.60 Å

CRYSTAL STRUCTURE OF HUMAN ADAMTS-4 IN COMPLEX WITH INHIBITOR 5- CHLORO-N-{[(4S)-4-(1-METHYL-1H-IMIDAZOL-2-YL)-2,5-DIOXOIMIDAZOLIDIN- 4-YL]METHYL}-1-BENZOFURAN-2-CARBOXAMIDE (COMPOUND 11)

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	`39`	`11`	`10226`	`x`	A	x-1/2,-y+1/2,-z+1	`4_456`	`48`	`13`	`10226`	`419.1`	`-2.4`	`0.499`	`3`	`0`	`0`	`0.000`
`2`		[3PW]A:506	`26`	`1`	`562`	`f`	A	x,y,z	`1_555`	`52`	`21`	`10226`	`355.7`	`-7.1`	`0.378`	`4`	`0`	`0`	`0.012`
`3`		A	`34`	`13`	`10226`	`x`	A	-x,y-1/2,-z+1/2	`3_545`	`36`	`13`	`10226`	`336.5`	`-2.3`	`0.496`	`2`	`2`	`0`	`0.000`
`4`		A	`31`	`11`	`10226`	`x`	A	x-1,y,z	`1_455`	`33`	`11`	`10226`	`292.3`	`-3.9`	`0.313`	`0`	`0`	`0`	`0.000`
`5`		A	`16`	`5`	`10226`	`x`	A	-x+1/2,-y,z-1/2	`2_554`	`24`	`8`	`10226`	`175.5`	`-0.1`	`0.560`	`2`	`7`	`0`	`0.000`
`6`		[EDO]A:505	`4`	`1`	`186`	`f`	A	x,y,z	`1_555`	`22`	`6`	`10226`	`113.8`	`3.1`	`0.463`	`2`	`0`	`0`	`0.000`
`7`		[CA]A:504	`1`	`1`	`85`	`f`	A	x,y,z	`1_555`	`6`	`5`	`10226`	`43.5`	`-12.6`	`0.000`	`0`	`0`	`0`	`0.017`
`8`		[CA]A:503	`1`	`1`	`85`	`f`	A	x,y,z	`1_555`	`6`	`6`	`10226`	`40.9`	`-11.1`	`0.000`	`0`	`0`	`0`	`0.015`
`9`		[ZN]A:501	`1`	`1`	`98`	`f`	A	x,y,z	`1_555`	`8`	`5`	`10226`	`37.0`	`-24.5`	`0.000`	`0`	`0`	`0`	`0.033`
`10`		[3PW]A:506	`7`	`1`	`562`	`f`	[ZN]A:501	x,y,z	`1_555`	`1`	`1`	`98`	`33.1`	`-14.7`	`0.000`	`0`	`0`	`0`	`0.020`
`11`		A	`3`	`2`	`10226`	`x`	A	-x-1/2,-y,z-1/2	`2_454`	`3`	`3`	`10226`	`28.1`	`0.0`	`0.618`	`0`	`0`	`0`	`0.000`
`12`		[CA]A:503	`1`	`1`	`85`	`f`	[CA]A:502	x,y,z	`1_555`	`1`	`1`	`85`	`10.8`	`-3.2`	`0.000`	`0`	`0`	`0`	`0.004`
`13`		[3PW]A:506	`1`	`1`	`562`	`f`	[EDO]A:505	x,y,z	`1_555`	`1`	`1`	`186`	`9.7`	`-0.6`	`0.392`	`0`	`0`	`0`	`0.000`
`14`		[3PW]A:506	`1`	`1`	`562`	`◊`	A	x-1,y,z	`1_455`	`2`	`1`	`10226`	`2.8`	`0.1`	`0.614`	`0`	`0`	`0`	`0.000`
`15`		A	`1`	`1`	`10226`	`x`	A	x-1/2,-y-1/2,-z+1	`4_446`	`1`	`1`	`10226`	`0.2`	`-0.0`	`0.656`	`0`	`0`	`0`	`0.000`

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

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