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Interfaces in PDB 6dq7 crystal.
Space symmetry group: C 1 2 1. Resolution: 1.85 Å

LINKED KDM5A JMJ DOMAIN BOUND TO THE POTENTIAL HYDROLYSIS PRODUCT OF INHIBITOR N45 I.E. 3-((6-(4-(2-CYANO-3-METHYLBUT-2-ENOYL)-1,4- DIAZEPAN-1-YL)-2-(PYRIDIN-2-YL)PYRIMIDIN-4-YL)AMINO)PROPANOIC ACID

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	`89`	`27`	`13977`	`x`	A	-x-1/2,y-1/2,-z	`4_445`	`83`	`26`	`13977`	`802.6`	`-8.4`	`0.400`	`2`	`2`	`0`	`0.000`
`2`		A	`61`	`20`	`13977`	`◊`	A	-x,y,-z	`2_555`	`60`	`20`	`13977`	`557.4`	`-6.8`	`0.385`	`6`	`0`	`0`	`0.000`
`3`		[H6M]A:601	`28`	`1`	`597`	`f`	A	x,y,z	`1_555`	`62`	`21`	`13977`	`396.5`	`-6.8`	`0.601`	`4`	`0`	`0`	`0.059`
`4`		A	`26`	`6`	`13977`	`x`	A	x,y,z-1	`1_554`	`28`	`8`	`13977`	`207.6`	`-3.7`	`0.320`	`1`	`0`	`0`	`0.000`
`5`		[GOL]A:604	`5`	`1`	`219`	`f`	A	x,y,z	`1_555`	`22`	`7`	`13977`	`99.0`	`-0.6`	`0.553`	`1`	`0`	`0`	`0.007`
`6`		[EDO]A:603	`4`	`1`	`184`	`f`	A	x,y,z	`1_555`	`14`	`8`	`13977`	`88.3`	`2.2`	`0.301`	`3`	`0`	`0`	`0.000`
`7`		A	`11`	`6`	`13977`	`x`	A	-x-1/2,y-1/2,-z+1	`4_446`	`8`	`5`	`13977`	`59.9`	`-0.9`	`0.477`	`0`	`0`	`0`	`0.000`
`8`		[GOL]A:604	`2`	`1`	`219`	`◊`	A	x,y,z-1	`1_554`	`11`	`4`	`13977`	`51.7`	`-0.6`	`0.538`	`0`	`0`	`0`	`0.000`
`9`		[MN]A:602	`1`	`1`	`123`	`f`	A	x,y,z	`1_555`	`8`	`4`	`13977`	`48.2`	`-3.3`	`0.000`	`0`	`0`	`0`	`0.022`
`10`		[MN]A:602	`1`	`1`	`123`	`f`	[H6M]A:601	x,y,z	`1_555`	`6`	`1`	`597`	`46.8`	`-2.6`	`0.000`	`0`	`0`	`0`	`0.018`

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

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PDBePISA

Protein Data Bank in Europe

Bringing Structure to Biology

PDBePISA

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