## |
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 |
|
L |
206 |
57 |
11652 |
◊ |
H |
x,y,z |
1_555 |
199 |
55 |
11962 |
1832.3 |
-23.7 |
0.066 |
14 |
2 |
0 |
1.000 |
2 |
|
F |
201 |
56 |
11639 |
◊ |
E |
x,y,z |
1_555 |
194 |
54 |
12033 |
1817.2 |
-24.2 |
0.046 |
19 |
3 |
0 |
1.000 |
3 |
|
B |
185 |
51 |
11790 |
◊ |
A |
x,y,z |
1_555 |
174 |
51 |
12061 |
1610.4 |
-21.6 |
0.075 |
13 |
2 |
0 |
1.000 |
4 |
|
D |
196 |
53 |
11778 |
◊ |
C |
x,y,z |
1_555 |
162 |
44 |
11911 |
1599.4 |
-22.8 |
0.048 |
17 |
3 |
0 |
1.000 |
Average: |
1714.8 |
-23.1 |
0.059 |
16 |
3 |
0 |
1.000 |
2 |
5 |
|
F |
43 |
12 |
11639 |
◊ |
D |
x-1,y,z |
1_455 |
46 |
15 |
11778 |
407.9 |
-2.6 |
0.444 |
7 |
3 |
0 |
0.000 |
6 |
|
L |
45 |
12 |
11652 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
48 |
15 |
11790 |
401.1 |
-3.0 |
0.408 |
6 |
0 |
0 |
0.000 |
Average: |
404.5 |
-2.8 |
0.426 |
7 |
2 |
0 |
0.000 |
3 |
7 |
|
F |
46 |
14 |
11639 |
◊ |
C |
x-1,y,z |
1_455 |
36 |
13 |
11911 |
387.5 |
0.4 |
0.737 |
6 |
0 |
0 |
0.000 |
8 |
|
L |
39 |
14 |
11652 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
42 |
13 |
12061 |
380.2 |
1.8 |
0.786 |
4 |
0 |
0 |
0.000 |
Average: |
383.8 |
1.1 |
0.762 |
5 |
0 |
0 |
0.000 |
4 |
9 |
|
B |
31 |
7 |
11790 |
◊ |
C |
x,y,z |
1_555 |
32 |
13 |
11911 |
330.3 |
0.3 |
0.674 |
7 |
4 |
0 |
0.000 |
5 |
10 |
|
E |
30 |
10 |
12033 |
◊ |
H |
x-1,y,z |
1_455 |
34 |
10 |
11962 |
279.3 |
-3.1 |
0.351 |
3 |
0 |
0 |
0.000 |
11 |
|
H |
29 |
10 |
11962 |
◊ |
E |
-x-1,y-1/2,-z-1/2 |
3_444 |
32 |
10 |
12033 |
253.2 |
-2.8 |
0.383 |
5 |
0 |
0 |
0.000 |
Average: |
266.3 |
-2.9 |
0.367 |
4 |
0 |
0 |
0.000 |
6 |
12 |
|
L |
26 |
11 |
11652 |
◊ |
F |
-x-1,y-1/2,-z-1/2 |
3_444 |
25 |
8 |
11639 |
243.6 |
0.2 |
0.668 |
4 |
0 |
0 |
0.000 |
13 |
|
F |
23 |
9 |
11639 |
◊ |
L |
x-1,y,z |
1_455 |
26 |
9 |
11652 |
227.0 |
-0.1 |
0.633 |
3 |
0 |
0 |
0.000 |
Average: |
235.3 |
0.1 |
0.650 |
4 |
0 |
0 |
0.000 |
7 |
14 |
|
H |
26 |
10 |
11962 |
◊ |
F |
-x-1,y-1/2,-z-1/2 |
3_444 |
28 |
9 |
11639 |
229.5 |
-3.1 |
0.255 |
0 |
0 |
0 |
0.000 |
15 |
|
E |
18 |
8 |
12033 |
◊ |
L |
x-1,y,z |
1_455 |
24 |
7 |
11652 |
180.3 |
-3.3 |
0.179 |
0 |
0 |
0 |
0.000 |
Average: |
204.9 |
-3.2 |
0.217 |
0 |
0 |
0 |
0.000 |
8 |
16 |
|
H |
28 |
9 |
11962 |
x |
H |
x-1/2,-y+1/2,-z |
4_455 |
22 |
8 |
11962 |
219.2 |
-4.1 |
0.188 |
2 |
0 |
0 |
0.000 |
9 |
17 |
|
E |
18 |
7 |
12033 |
◊ |
C |
x,y,z |
1_555 |
21 |
9 |
11911 |
192.5 |
-1.2 |
0.531 |
1 |
0 |
0 |
0.000 |
10 |
18 |
|
D |
19 |
7 |
11778 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
25 |
10 |
12061 |
190.3 |
0.3 |
0.711 |
4 |
0 |
0 |
0.000 |
11 |
19 |
|
D |
17 |
5 |
11778 |
◊ |
E |
-x-1,y-1/2,-z-1/2 |
3_444 |
20 |
7 |
12033 |
156.5 |
0.4 |
0.619 |
1 |
0 |
0 |
0.000 |
12 |
20 |
|
F |
15 |
10 |
11639 |
◊ |
B |
x-1,y,z |
1_455 |
16 |
8 |
11790 |
155.6 |
0.9 |
0.750 |
3 |
0 |
0 |
0.000 |
13 |
21 |
|
F |
20 |
8 |
11639 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
23 |
11 |
12061 |
146.4 |
1.1 |
0.791 |
2 |
0 |
0 |
0.000 |
22 |
|
L |
15 |
7 |
11652 |
◊ |
C |
-x,y-1/2,-z-1/2 |
3_544 |
18 |
7 |
11911 |
111.1 |
-0.8 |
0.524 |
0 |
0 |
0 |
0.000 |
Average: |
128.7 |
0.2 |
0.657 |
1 |
0 |
0 |
0.000 |
14 |
23 |
|
L |
14 |
7 |
11652 |
◊ |
D |
x,y,z |
1_555 |
15 |
5 |
11778 |
119.6 |
-0.1 |
0.609 |
2 |
0 |
0 |
0.000 |
15 |
24 |
|
D |
10 |
4 |
11778 |
◊ |
A |
-x-1/2,-y+1,z-1/2 |
2_464 |
9 |
3 |
12061 |
102.0 |
-0.6 |
0.460 |
2 |
0 |
0 |
0.000 |
16 |
25 |
|
D |
11 |
4 |
11778 |
◊ |
F |
-x-1,y-1/2,-z-1/2 |
3_444 |
12 |
6 |
11639 |
99.9 |
-0.5 |
0.388 |
0 |
1 |
0 |
0.000 |
17 |
26 |
|
L |
10 |
4 |
11652 |
◊ |
B |
x,y,z |
1_555 |
14 |
5 |
11790 |
96.5 |
-0.7 |
0.499 |
0 |
0 |
0 |
0.000 |
18 |
27 |
|
[SO4]H:301 |
5 |
1 |
185 |
f |
H |
x,y,z |
1_555 |
9 |
4 |
11962 |
74.7 |
-10.0 |
0.835 |
2 |
0 |
0 |
0.266 |
19 |
28 |
|
H |
8 |
3 |
11962 |
◊ |
[SO4]H:301 |
x-1/2,-y+1/2,-z |
4_455 |
4 |
1 |
185 |
40.3 |
-5.3 |
0.769 |
0 |
0 |
0 |
0.000 |
20 |
29 |
|
C |
3 |
1 |
11911 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
4 |
1 |
12061 |
38.8 |
0.8 |
0.868 |
1 |
0 |
0 |
0.000 |
21 |
30 |
|
D |
3 |
1 |
11778 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
4 |
1 |
12061 |
33.8 |
0.4 |
0.767 |
0 |
1 |
0 |
0.000 |
22 |
31 |
|
D |
2 |
1 |
11778 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
11790 |
22.7 |
-0.1 |
0.561 |
0 |
0 |
0 |
0.000 |
23 |
32 |
|
B |
1 |
1 |
11790 |
◊ |
H |
x,y,z |
1_555 |
2 |
1 |
11962 |
15.1 |
0.4 |
0.834 |
1 |
0 |
0 |
0.000 |
24 |
33 |
|
C |
1 |
1 |
11911 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
12061 |
13.0 |
0.3 |
0.840 |
0 |
0 |
0 |
0.000 |
25 |
34 |
|
L |
1 |
1 |
11652 |
◊ |
E |
-x-1,y-1/2,-z-1/2 |
3_444 |
1 |
1 |
12033 |
2.8 |
0.1 |
0.757 |
0 |
0 |
0 |
0.000 |
|