## |
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 |
|
B |
55 |
13 |
9471 |
◊ |
A |
-x,y,-z+1 |
2_556 |
55 |
18 |
9222 |
496.8 |
2.7 |
0.796 |
4 |
2 |
0 |
0.000 |
2 |
2 |
|
D |
54 |
16 |
9387 |
◊ |
A |
x,y,z |
1_555 |
57 |
15 |
9222 |
481.8 |
-4.6 |
0.263 |
5 |
0 |
0 |
0.000 |
3 |
3 |
|
D |
53 |
14 |
9387 |
◊ |
C |
x,y,z |
1_555 |
46 |
13 |
9557 |
476.0 |
1.2 |
0.686 |
7 |
5 |
0 |
0.000 |
4 |
|
B |
49 |
14 |
9471 |
◊ |
A |
x,y,z |
1_555 |
42 |
12 |
9222 |
427.1 |
0.2 |
0.643 |
6 |
6 |
0 |
0.000 |
Average: |
451.6 |
0.7 |
0.664 |
7 |
6 |
0 |
0.000 |
4 |
5 |
|
D |
41 |
13 |
9387 |
◊ |
B |
x,y,z |
1_555 |
43 |
13 |
9471 |
414.5 |
-1.7 |
0.453 |
8 |
0 |
0 |
0.000 |
5 |
6 |
|
D |
35 |
8 |
9387 |
◊ |
C |
-x-1/2,y-1/2,-z |
4_445 |
40 |
10 |
9557 |
329.9 |
0.3 |
0.659 |
5 |
0 |
0 |
0.000 |
6 |
7 |
|
C |
39 |
9 |
9557 |
◊ |
B |
x,y,z |
1_555 |
37 |
11 |
9471 |
317.7 |
-3.3 |
0.278 |
2 |
0 |
0 |
0.000 |
7 |
8 |
|
C |
28 |
9 |
9557 |
◊ |
B |
x,y-1,z |
1_545 |
30 |
11 |
9471 |
271.2 |
0.5 |
0.668 |
3 |
1 |
0 |
0.000 |
8 |
9 |
|
C |
31 |
12 |
9557 |
◊ |
A |
x,y,z-1 |
1_554 |
29 |
11 |
9222 |
259.5 |
1.4 |
0.756 |
4 |
3 |
0 |
0.000 |
9 |
10 |
|
[8GK]D:301 |
14 |
1 |
344 |
f |
D |
x,y,z |
1_555 |
36 |
14 |
9387 |
215.2 |
4.4 |
0.150 |
2 |
0 |
0 |
0.000 |
11 |
|
[8GK]B:301 |
14 |
1 |
345 |
f |
B |
x,y,z |
1_555 |
35 |
13 |
9471 |
213.4 |
4.4 |
0.149 |
3 |
0 |
0 |
0.000 |
Average: |
214.3 |
4.4 |
0.150 |
3 |
0 |
0 |
0.000 |
10 |
12 |
|
B |
24 |
8 |
9471 |
x |
B |
x,y-1,z |
1_545 |
21 |
9 |
9471 |
180.7 |
0.1 |
0.597 |
1 |
2 |
0 |
0.000 |
13 |
|
A |
17 |
4 |
9222 |
x |
A |
x,y-1,z |
1_545 |
15 |
5 |
9222 |
120.9 |
-0.9 |
0.473 |
1 |
0 |
0 |
0.000 |
Average: |
150.8 |
-0.4 |
0.535 |
1 |
1 |
0 |
0.000 |
11 |
14 |
|
[8GK]C:301 |
14 |
1 |
346 |
f |
C |
x,y,z |
1_555 |
25 |
11 |
9557 |
172.8 |
3.1 |
0.061 |
3 |
0 |
0 |
0.000 |
15 |
|
[8GK]A:301 |
14 |
1 |
345 |
f |
A |
x,y,z |
1_555 |
25 |
11 |
9222 |
170.7 |
3.2 |
0.065 |
3 |
0 |
0 |
0.000 |
Average: |
171.7 |
3.1 |
0.063 |
3 |
0 |
0 |
0.000 |
12 |
16 |
|
[PGE]D:302 |
10 |
1 |
335 |
◊ |
D |
x,y,z |
1_555 |
24 |
6 |
9387 |
137.2 |
3.0 |
0.214 |
2 |
0 |
0 |
0.000 |
13 |
17 |
|
[PGE]D:302 |
10 |
1 |
335 |
f |
B |
x,y,z |
1_555 |
27 |
7 |
9471 |
134.4 |
1.7 |
0.133 |
3 |
0 |
0 |
0.000 |
14 |
18 |
|
D |
13 |
4 |
9387 |
x |
D |
x,y-1,z |
1_545 |
12 |
5 |
9387 |
115.9 |
0.2 |
0.623 |
2 |
1 |
0 |
0.000 |
15 |
19 |
|
D |
12 |
5 |
9387 |
x |
D |
-x-1/2,y-1/2,-z+1 |
4_446 |
15 |
4 |
9387 |
101.3 |
0.4 |
0.581 |
0 |
0 |
0 |
0.000 |
16 |
20 |
|
[EDO]B:302 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
16 |
6 |
9471 |
97.2 |
2.8 |
0.474 |
5 |
0 |
0 |
0.000 |
17 |
21 |
|
[8GK]A:301 |
11 |
1 |
345 |
◊ |
D |
x,y,z |
1_555 |
12 |
4 |
9387 |
87.4 |
3.2 |
0.109 |
0 |
0 |
0 |
0.000 |
18 |
22 |
|
[8GK]C:301 |
8 |
1 |
346 |
◊ |
B |
x,y,z |
1_555 |
11 |
4 |
9471 |
75.5 |
3.0 |
0.231 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
A |
6 |
3 |
9222 |
◊ |
D |
-x-1/2,y-1/2,-z+1 |
4_446 |
11 |
3 |
9387 |
74.9 |
-1.2 |
0.174 |
0 |
0 |
0 |
0.000 |
20 |
24 |
|
[NA]C:302 |
1 |
1 |
125 |
f |
A |
x,y,z-1 |
1_554 |
8 |
4 |
9222 |
66.3 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.021 |
21 |
25 |
|
C |
7 |
4 |
9557 |
◊ |
B |
-x,y,-z |
2_555 |
11 |
4 |
9471 |
65.3 |
-1.1 |
0.286 |
0 |
0 |
0 |
0.000 |
22 |
26 |
|
[NA]D:303 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
7 |
5 |
9387 |
65.1 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.026 |
23 |
27 |
|
D |
7 |
4 |
9387 |
◊ |
A |
x,y-1,z |
1_545 |
6 |
2 |
9222 |
57.9 |
0.1 |
0.588 |
0 |
0 |
0 |
0.000 |
24 |
28 |
|
[ZN]B:303 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
9471 |
37.9 |
-25.6 |
0.000 |
0 |
0 |
0 |
0.073 |
29 |
|
[ZN]A:302 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
9222 |
37.9 |
-25.3 |
0.000 |
0 |
0 |
0 |
0.073 |
30 |
|
[ZN]C:303 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
9 |
6 |
9557 |
37.7 |
-25.4 |
0.000 |
0 |
0 |
0 |
0.073 |
31 |
|
[ZN]D:304 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
9 |
6 |
9387 |
37.2 |
-25.7 |
0.000 |
0 |
0 |
0 |
0.073 |
Average: |
37.7 |
-25.5 |
0.000 |
0 |
0 |
0 |
0.073 |
25 |
32 |
|
[ZN]C:303 |
1 |
1 |
98 |
f |
[8GK]C:301 |
x,y,z |
1_555 |
5 |
1 |
346 |
32.1 |
-13.8 |
0.000 |
0 |
0 |
0 |
0.039 |
33 |
|
[ZN]B:303 |
1 |
1 |
98 |
f |
[8GK]B:301 |
x,y,z |
1_555 |
3 |
1 |
345 |
31.8 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.039 |
34 |
|
[ZN]D:304 |
1 |
1 |
98 |
f |
[8GK]D:301 |
x,y,z |
1_555 |
3 |
1 |
344 |
31.7 |
-13.6 |
0.000 |
0 |
0 |
0 |
0.039 |
35 |
|
[ZN]A:302 |
1 |
1 |
98 |
f |
[8GK]A:301 |
x,y,z |
1_555 |
3 |
1 |
345 |
31.6 |
-14.0 |
0.000 |
0 |
0 |
0 |
0.039 |
Average: |
31.8 |
-13.8 |
0.000 |
0 |
0 |
0 |
0.039 |
26 |
36 |
|
[NA]C:302 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
9557 |
18.0 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.000 |
|