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(id=983-64-D89)
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STROMELYSIN-1 CATALYTIC DOMAIN WITH HYDROPHOBIC INHIBITOR BOUND, PH 7.0, 32OC, 20 MM CACL2, 15% ACETONITRILE; NMR AVERAGE OF 20 STRUCTURES MINIMIZED WITH RESTRAINTS
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##
Structure 1
×
Structure 2
interface
area, Å
2
Δ
i
G
kcal/mol
Δ
i
G
P-value
N
HB
N
SB
N
DS
CSS
NN
«»
Range
i
N
at
i
N
res
Surface Å
2
Range
i
N
at
i
N
res
Surface Å
2
1
A
58
18
7765
◊
[0DS]A:261
28
1
710
401.2
-3.9
0.257
2
0
0
0.000
2
A
7
5
7765
◊
[ZN]A:1
1
1
98
37.2
-26.3
0.000
0
0
0
0.000
3
[ZN]A:1
1
1
98
◊
[0DS]A:261
4
1
710
30.9
-13.9
0.000
0
0
0
0.000
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PDBe PISA v1.52 [20/10/2014]