## |
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 |
316 |
81 |
11307 |
◊ |
A |
x,y,z |
1_555 |
311 |
79 |
11151 |
3072.0 |
-49.2 |
0.040 |
29 |
8 |
0 |
0.666 |
2 |
|
D |
302 |
81 |
11259 |
◊ |
C |
x,y,z |
1_555 |
301 |
76 |
11135 |
3005.4 |
-53.2 |
0.063 |
20 |
7 |
0 |
0.666 |
Average: |
3038.7 |
-51.2 |
0.051 |
25 |
8 |
0 |
0.666 |
2 |
3 |
|
D |
66 |
17 |
11259 |
◊ |
B |
x-1,y,z |
1_455 |
70 |
15 |
11307 |
571.0 |
-4.3 |
0.713 |
11 |
0 |
0 |
0.004 |
3 |
4 |
|
C |
36 |
10 |
11135 |
◊ |
A |
x-1,y+1,z |
1_465 |
49 |
15 |
11151 |
399.1 |
-4.1 |
0.503 |
2 |
0 |
0 |
0.000 |
4 |
5 |
|
D |
38 |
7 |
11259 |
◊ |
A |
x,y,z |
1_555 |
37 |
8 |
11151 |
303.7 |
-4.1 |
0.503 |
3 |
0 |
0 |
0.000 |
5 |
6 |
|
B |
26 |
8 |
11307 |
◊ |
D |
x,y-1,z+1 |
1_546 |
24 |
10 |
11259 |
252.6 |
-3.1 |
0.459 |
2 |
2 |
0 |
0.000 |
6 |
7 |
|
[K31]A:303 |
13 |
1 |
365 |
◊ |
B |
x,y,z |
1_555 |
24 |
7 |
11307 |
184.4 |
2.9 |
0.300 |
0 |
0 |
0 |
0.000 |
7 |
8 |
|
[K31]B:305 |
13 |
1 |
362 |
f |
A |
x,y,z |
1_555 |
22 |
7 |
11151 |
176.8 |
2.2 |
0.241 |
0 |
0 |
0 |
0.000 |
8 |
9 |
|
[K31]B:305 |
9 |
1 |
362 |
◊ |
B |
x,y,z |
1_555 |
22 |
5 |
11307 |
130.5 |
3.9 |
0.574 |
0 |
0 |
0 |
0.000 |
9 |
10 |
|
C |
13 |
9 |
11135 |
◊ |
B |
x-1,y,z |
1_455 |
10 |
2 |
11307 |
125.2 |
-1.0 |
0.300 |
2 |
0 |
0 |
0.000 |
10 |
11 |
|
B |
14 |
4 |
11307 |
◊ |
A |
x-1,y,z |
1_455 |
13 |
3 |
11151 |
118.9 |
-1.6 |
0.450 |
1 |
0 |
0 |
0.000 |
11 |
12 |
|
[K31]A:303 |
8 |
1 |
365 |
f |
A |
x,y,z |
1_555 |
22 |
5 |
11151 |
116.0 |
2.1 |
0.451 |
0 |
0 |
0 |
0.000 |
12 |
13 |
|
D |
9 |
3 |
11259 |
◊ |
A |
x-1,y,z |
1_455 |
12 |
8 |
11151 |
112.6 |
-0.7 |
0.342 |
0 |
0 |
0 |
0.000 |
13 |
14 |
|
[EDO]B:306 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
16 |
10 |
11307 |
106.0 |
3.4 |
0.508 |
2 |
0 |
0 |
0.000 |
14 |
15 |
|
[EDO]A:304 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
16 |
10 |
11151 |
102.6 |
3.4 |
0.533 |
1 |
0 |
0 |
0.000 |
15 |
16 |
|
D |
13 |
5 |
11259 |
◊ |
A |
x-1,y+1,z-1 |
1_464 |
11 |
6 |
11151 |
101.3 |
-2.1 |
0.353 |
0 |
0 |
0 |
0.000 |
16 |
17 |
|
[EDO]C:301 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
12 |
6 |
11135 |
99.4 |
3.4 |
0.577 |
3 |
0 |
0 |
0.000 |
17 |
18 |
|
[EDO]B:302 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
15 |
4 |
11307 |
88.3 |
2.2 |
0.302 |
3 |
0 |
0 |
0.000 |
18 |
19 |
|
[MG]B:303 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
11307 |
55.7 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.289 |
20 |
|
[MG]D:301 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
12 |
7 |
11259 |
52.7 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.289 |
21 |
|
[MG]A:301 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
11151 |
50.6 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.289 |
22 |
|
[MG]C:302 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
7 |
11135 |
49.9 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.289 |
23 |
|
[MG]C:303 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
13 |
7 |
11135 |
49.5 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.289 |
24 |
|
[MG]D:302 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
5 |
5 |
11259 |
45.6 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.289 |
Average: |
50.7 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.289 |
19 |
25 |
|
[CL]B:301 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
6 |
5 |
11307 |
55.6 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.083 |
20 |
26 |
|
B |
7 |
1 |
11307 |
x |
B |
x-1,y,z |
1_455 |
10 |
3 |
11307 |
53.8 |
-1.3 |
0.375 |
0 |
0 |
0 |
0.000 |
21 |
27 |
|
[MG]B:304 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
11307 |
48.2 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.181 |
28 |
|
[MG]A:302 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
6 |
11151 |
45.6 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.181 |
Average: |
46.9 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.181 |
22 |
29 |
|
D |
7 |
3 |
11259 |
x |
D |
x,y-1,z |
1_545 |
7 |
2 |
11259 |
38.5 |
-0.3 |
0.647 |
0 |
0 |
0 |
0.000 |
23 |
30 |
|
A |
5 |
2 |
11151 |
◊ |
B |
x,y-1,z |
1_545 |
2 |
2 |
11307 |
37.4 |
-0.8 |
0.222 |
0 |
0 |
0 |
0.000 |
24 |
31 |
|
[EDO]A:304 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
11307 |
37.2 |
0.7 |
0.897 |
2 |
0 |
0 |
0.002 |
25 |
32 |
|
D |
5 |
4 |
11259 |
◊ |
C |
x,y-1,z |
1_545 |
5 |
4 |
11135 |
36.1 |
-0.7 |
0.471 |
0 |
0 |
0 |
0.000 |
26 |
33 |
|
[EDO]B:306 |
3 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
11151 |
35.9 |
0.7 |
0.906 |
2 |
0 |
0 |
0.002 |
27 |
34 |
|
C |
4 |
2 |
11135 |
◊ |
B |
x,y,z-1 |
1_554 |
8 |
4 |
11307 |
29.3 |
-0.7 |
0.439 |
0 |
0 |
0 |
0.000 |
28 |
35 |
|
D |
3 |
1 |
11259 |
◊ |
B |
x,y,z-1 |
1_554 |
4 |
2 |
11307 |
27.9 |
-0.5 |
0.453 |
0 |
0 |
0 |
0.000 |
29 |
36 |
|
[MG]C:303 |
1 |
1 |
98 |
f |
[MG]C:302 |
x,y,z |
1_555 |
1 |
1 |
98 |
25.2 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.050 |
30 |
37 |
|
[CL]B:301 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
6 |
1 |
11151 |
24.5 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.030 |
31 |
38 |
|
[MG]D:302 |
1 |
1 |
98 |
f |
[MG]D:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
23.9 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.048 |
32 |
39 |
|
[MG]A:302 |
1 |
1 |
98 |
f |
[MG]A:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
18.6 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.039 |
33 |
40 |
|
A |
3 |
1 |
11151 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
1 |
11307 |
6.2 |
-0.1 |
0.595 |
0 |
0 |
0 |
0.000 |
34 |
41 |
|
[MG]B:304 |
1 |
1 |
98 |
f |
[MG]B:303 |
x,y,z |
1_555 |
1 |
1 |
98 |
4.1 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.009 |
35 |
42 |
|
C |
1 |
1 |
11135 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
11151 |
2.3 |
-0.0 |
0.587 |
0 |
0 |
0 |
0.000 |
|