## |
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 |
312 |
79 |
11157 |
◊ |
A |
x,y,z |
1_555 |
306 |
79 |
11062 |
3042.1 |
-48.1 |
0.038 |
24 |
13 |
0 |
0.706 |
2 |
|
D |
307 |
79 |
11284 |
◊ |
C |
x,y,z |
1_555 |
297 |
74 |
10824 |
3019.7 |
-48.6 |
0.095 |
27 |
11 |
0 |
0.706 |
Average: |
3030.9 |
-48.3 |
0.066 |
26 |
12 |
0 |
0.706 |
2 |
3 |
|
D |
68 |
17 |
11284 |
◊ |
B |
x-1,y,z |
1_455 |
70 |
18 |
11157 |
521.3 |
-3.6 |
0.743 |
7 |
0 |
0 |
0.000 |
3 |
4 |
|
C |
35 |
10 |
10824 |
◊ |
A |
x-1,y+1,z |
1_465 |
43 |
15 |
11062 |
385.3 |
-4.5 |
0.415 |
2 |
0 |
0 |
0.000 |
4 |
5 |
|
D |
38 |
7 |
11284 |
◊ |
A |
x,y,z |
1_555 |
33 |
8 |
11062 |
295.7 |
-3.2 |
0.547 |
2 |
0 |
0 |
0.000 |
5 |
6 |
|
B |
22 |
8 |
11157 |
◊ |
D |
x,y-1,z+1 |
1_546 |
23 |
7 |
11284 |
223.2 |
-2.5 |
0.482 |
2 |
2 |
0 |
0.000 |
6 |
7 |
|
[K0P]D:303 |
15 |
1 |
439 |
◊ |
D |
x,y,z |
1_555 |
23 |
8 |
11284 |
180.5 |
3.5 |
0.327 |
0 |
0 |
0 |
0.000 |
7 |
8 |
|
[K0P]B:304 |
15 |
1 |
440 |
◊ |
A |
x,y,z |
1_555 |
24 |
8 |
11062 |
175.3 |
3.5 |
0.313 |
0 |
0 |
0 |
0.000 |
8 |
9 |
|
[K0P]B:304 |
15 |
1 |
440 |
f |
B |
x,y,z |
1_555 |
23 |
7 |
11157 |
163.6 |
2.8 |
0.238 |
1 |
0 |
0 |
0.000 |
9 |
10 |
|
[K0P]D:303 |
15 |
1 |
439 |
f |
C |
x,y,z |
1_555 |
22 |
7 |
10824 |
161.0 |
3.2 |
0.274 |
1 |
0 |
0 |
0.000 |
10 |
11 |
|
D |
14 |
4 |
11284 |
◊ |
A |
x-1,y+1,z-1 |
1_464 |
16 |
8 |
11062 |
141.6 |
-2.8 |
0.321 |
0 |
0 |
0 |
0.000 |
11 |
12 |
|
D |
9 |
2 |
11284 |
◊ |
A |
x-1,y,z |
1_455 |
15 |
9 |
11062 |
129.0 |
-0.9 |
0.288 |
1 |
0 |
0 |
0.000 |
13 |
|
C |
13 |
9 |
10824 |
◊ |
B |
x-1,y,z |
1_455 |
9 |
2 |
11157 |
121.8 |
-1.1 |
0.247 |
1 |
0 |
0 |
0.000 |
Average: |
125.4 |
-1.0 |
0.268 |
1 |
0 |
0 |
0.000 |
12 |
14 |
|
B |
13 |
3 |
11157 |
◊ |
A |
x-1,y,z |
1_455 |
13 |
3 |
11062 |
106.9 |
-1.5 |
0.466 |
1 |
0 |
0 |
0.000 |
13 |
15 |
|
[EDO]C:304 |
4 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
16 |
11 |
10824 |
106.3 |
3.4 |
0.543 |
2 |
0 |
0 |
0.000 |
16 |
|
[EDO]D:304 |
4 |
1 |
183 |
◊ |
D |
x,y,z |
1_555 |
15 |
10 |
11284 |
102.8 |
3.3 |
0.543 |
2 |
0 |
0 |
0.000 |
Average: |
104.5 |
3.4 |
0.543 |
2 |
0 |
0 |
0.000 |
14 |
17 |
|
[EDO]B:305 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
13 |
9 |
11157 |
104.0 |
3.2 |
0.504 |
2 |
0 |
0 |
0.000 |
18 |
|
[EDO]A:304 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
16 |
11 |
11062 |
101.9 |
3.3 |
0.525 |
2 |
0 |
0 |
0.000 |
Average: |
103.0 |
3.3 |
0.514 |
2 |
0 |
0 |
0.000 |
15 |
19 |
|
[EDO]C:301 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
13 |
7 |
10824 |
102.3 |
3.6 |
0.579 |
4 |
0 |
0 |
0.000 |
16 |
20 |
|
[EDO]B:301 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
15 |
5 |
11157 |
90.2 |
2.2 |
0.303 |
3 |
0 |
0 |
0.000 |
17 |
21 |
|
[CL]A:303 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
9 |
11157 |
59.5 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.074 |
18 |
22 |
|
B |
7 |
1 |
11157 |
x |
B |
x-1,y,z |
1_455 |
8 |
2 |
11157 |
55.3 |
-0.2 |
0.598 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
[MG]B:302 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
11157 |
53.2 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.314 |
24 |
|
[MG]A:301 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
11062 |
50.7 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.314 |
25 |
|
[MG]C:303 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
13 |
7 |
10824 |
48.6 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.314 |
26 |
|
[MG]C:302 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
10824 |
48.1 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.314 |
27 |
|
[MG]D:301 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
12 |
7 |
11284 |
46.9 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.314 |
28 |
|
[MG]D:302 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
7 |
5 |
11284 |
45.6 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.314 |
Average: |
48.9 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.314 |
20 |
29 |
|
[MG]B:303 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
11157 |
49.6 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.159 |
30 |
|
[MG]A:302 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
11062 |
47.1 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.159 |
Average: |
48.3 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.159 |
21 |
31 |
|
[EDO]A:304 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
11157 |
40.4 |
0.8 |
0.894 |
2 |
0 |
0 |
0.002 |
32 |
|
[EDO]B:305 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
11062 |
39.9 |
0.8 |
0.898 |
2 |
0 |
0 |
0.002 |
Average: |
40.2 |
0.8 |
0.896 |
2 |
0 |
0 |
0.002 |
22 |
33 |
|
[EDO]C:304 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
6 |
2 |
11284 |
39.9 |
0.7 |
0.908 |
2 |
0 |
0 |
0.003 |
34 |
|
[EDO]D:304 |
4 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
5 |
2 |
10824 |
39.4 |
0.8 |
0.920 |
2 |
0 |
0 |
0.003 |
Average: |
39.6 |
0.8 |
0.914 |
2 |
0 |
0 |
0.003 |
23 |
35 |
|
A |
5 |
2 |
11062 |
◊ |
B |
x,y-1,z |
1_545 |
1 |
1 |
11157 |
39.1 |
-0.8 |
0.104 |
0 |
0 |
0 |
0.000 |
24 |
36 |
|
[CL]A:303 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
8 |
1 |
11062 |
33.5 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.041 |
25 |
37 |
|
D |
6 |
3 |
11284 |
x |
D |
x,y-1,z |
1_545 |
6 |
2 |
11284 |
33.4 |
-0.6 |
0.548 |
0 |
0 |
0 |
0.000 |
26 |
38 |
|
D |
3 |
3 |
11284 |
◊ |
C |
x,y-1,z |
1_545 |
6 |
4 |
10824 |
29.7 |
-0.5 |
0.464 |
0 |
0 |
0 |
0.000 |
27 |
39 |
|
[MG]D:302 |
1 |
1 |
98 |
f |
[MG]D:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
27.7 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.063 |
28 |
40 |
|
[MG]C:303 |
1 |
1 |
98 |
f |
[MG]C:302 |
x,y,z |
1_555 |
1 |
1 |
98 |
27.3 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.062 |
29 |
41 |
|
D |
2 |
1 |
11284 |
◊ |
B |
x,y,z-1 |
1_554 |
5 |
2 |
11157 |
26.9 |
-0.7 |
0.297 |
0 |
0 |
0 |
0.000 |
30 |
42 |
|
[MG]A:302 |
1 |
1 |
98 |
f |
[MG]A:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.0 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.040 |
31 |
43 |
|
[MG]B:303 |
1 |
1 |
98 |
f |
[MG]B:302 |
x,y,z |
1_555 |
1 |
1 |
98 |
16.3 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.033 |
32 |
44 |
|
C |
2 |
2 |
10824 |
◊ |
B |
x,y,z-1 |
1_554 |
4 |
2 |
11157 |
15.7 |
-0.4 |
0.415 |
0 |
0 |
0 |
0.000 |
33 |
45 |
|
C |
2 |
1 |
10824 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
11062 |
7.5 |
-0.0 |
0.586 |
0 |
0 |
0 |
0.000 |
34 |
46 |
|
A |
2 |
1 |
11062 |
◊ |
B |
x-1,y,z |
1_455 |
1 |
1 |
11157 |
3.5 |
-0.1 |
0.508 |
0 |
0 |
0 |
0.000 |
35 |
47 |
|
A |
1 |
1 |
11062 |
◊ |
D |
x,y-1,z+1 |
1_546 |
1 |
1 |
11284 |
2.2 |
0.1 |
0.748 |
0 |
0 |
0 |
0.000 |
|