## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
D |
95 |
30 |
12433 |
◊ |
B |
x,y,z |
1_555 |
94 |
31 |
12623 |
852.2 |
-7.5 |
0.318 |
9 |
3 |
0 |
0.014 |
2 |
|
F |
93 |
32 |
12703 |
◊ |
F |
x,-y+1,-z-1 |
2_564 |
93 |
32 |
12703 |
828.5 |
-7.2 |
0.295 |
11 |
4 |
0 |
0.014 |
Average: |
840.4 |
-7.4 |
0.306 |
10 |
4 |
0 |
0.014 |
2 |
3 |
|
F |
23 |
7 |
12703 |
◊ |
D |
-x,y-1/2,-z-1/2 |
3_544 |
29 |
11 |
12433 |
280.2 |
-7.3 |
0.024 |
1 |
3 |
0 |
0.064 |
3 |
4 |
|
[IWD]B:601 |
15 |
1 |
394 |
f |
B |
x,y,z |
1_555 |
49 |
18 |
12623 |
267.6 |
3.5 |
0.504 |
12 |
0 |
0 |
0.043 |
5 |
|
[IWD]F:601 |
15 |
1 |
389 |
f |
F |
x,y,z |
1_555 |
48 |
18 |
12703 |
266.4 |
3.5 |
0.501 |
12 |
0 |
0 |
0.043 |
6 |
|
[IWD]D:601 |
15 |
1 |
388 |
f |
D |
x,y,z |
1_555 |
48 |
17 |
12433 |
264.3 |
3.5 |
0.524 |
12 |
0 |
0 |
0.043 |
Average: |
266.1 |
3.5 |
0.510 |
12 |
0 |
0 |
0.043 |
4 |
7 |
|
F |
21 |
6 |
12703 |
◊ |
B |
x,y,z |
1_555 |
26 |
9 |
12623 |
254.8 |
-0.8 |
0.546 |
4 |
5 |
0 |
0.036 |
5 |
8 |
|
B |
24 |
8 |
12623 |
◊ |
D |
-x,y-1/2,-z-1/2 |
3_544 |
28 |
10 |
12433 |
253.7 |
2.1 |
0.540 |
7 |
3 |
0 |
0.015 |
6 |
9 |
|
F |
22 |
9 |
12703 |
x |
F |
x-1,y,z |
1_455 |
22 |
9 |
12703 |
156.5 |
-0.8 |
0.515 |
0 |
0 |
0 |
0.000 |
10 |
|
B |
22 |
9 |
12623 |
x |
B |
x-1,y,z |
1_455 |
18 |
7 |
12623 |
148.3 |
-0.9 |
0.521 |
0 |
0 |
0 |
0.000 |
11 |
|
D |
24 |
10 |
12433 |
x |
D |
x-1,y,z |
1_455 |
18 |
8 |
12433 |
147.4 |
-0.9 |
0.535 |
0 |
0 |
0 |
0.000 |
Average: |
150.8 |
-0.9 |
0.524 |
0 |
0 |
0 |
0.000 |
7 |
12 |
|
D |
9 |
3 |
12433 |
◊ |
B |
x,-y+1,-z |
2_565 |
19 |
7 |
12623 |
149.7 |
-3.4 |
0.048 |
1 |
0 |
0 |
0.000 |
8 |
13 |
|
F |
11 |
4 |
12703 |
◊ |
B |
-x,-y+1/2,z-1/2 |
4_554 |
11 |
3 |
12623 |
102.7 |
1.1 |
0.778 |
2 |
3 |
0 |
0.003 |
9 |
14 |
|
F |
9 |
3 |
12703 |
◊ |
D |
x,y,z |
1_555 |
7 |
2 |
12433 |
65.8 |
-0.7 |
0.404 |
0 |
0 |
0 |
0.000 |
10 |
15 |
|
[ZN]D:262 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
11 |
6 |
12433 |
49.6 |
-31.2 |
0.000 |
0 |
0 |
0 |
0.564 |
16 |
|
[ZN]F:262 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
12 |
6 |
12703 |
44.2 |
-25.9 |
0.000 |
0 |
0 |
0 |
0.564 |
17 |
|
[ZN]B:2 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
12623 |
39.1 |
-21.6 |
0.000 |
0 |
0 |
0 |
0.564 |
Average: |
44.3 |
-26.2 |
0.000 |
0 |
0 |
0 |
0.564 |
11 |
18 |
|
[ZN]B:1 |
1 |
1 |
98 |
f |
D |
-x,y-1/2,-z-1/2 |
3_544 |
6 |
3 |
12433 |
41.5 |
-20.2 |
0.000 |
0 |
0 |
0 |
0.209 |
12 |
19 |
|
[ZN]B:2 |
1 |
1 |
98 |
◊ |
F |
x,y,z |
1_555 |
7 |
3 |
12703 |
38.6 |
-18.0 |
0.000 |
0 |
0 |
0 |
0.195 |
13 |
20 |
|
[ZN]B:1 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
12623 |
37.9 |
-18.9 |
0.000 |
0 |
0 |
0 |
0.195 |
14 |
21 |
|
F |
7 |
3 |
12703 |
f |
[ZN]D:3 |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
98 |
36.7 |
-20.0 |
0.000 |
0 |
0 |
0 |
0.238 |
15 |
22 |
|
[ZN]D:3 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
6 |
3 |
12433 |
35.8 |
-18.7 |
0.000 |
0 |
0 |
0 |
0.147 |
16 |
23 |
|
[ZN]F:262 |
1 |
1 |
98 |
◊ |
B |
-x,-y+1/2,z-1/2 |
4_554 |
3 |
1 |
12623 |
30.5 |
-12.8 |
0.000 |
0 |
0 |
0 |
0.152 |
17 |
24 |
|
B |
2 |
1 |
12623 |
◊ |
D |
-x-1,y-1/2,-z-1/2 |
3_444 |
1 |
1 |
12433 |
17.5 |
1.3 |
0.952 |
0 |
0 |
0 |
0.000 |
|