## |
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 |
130 |
33 |
10654 |
◊ |
A |
x,y,z |
1_555 |
134 |
33 |
10814 |
1280.6 |
-17.4 |
0.099 |
10 |
2 |
0 |
0.602 |
2 |
|
D |
130 |
33 |
10866 |
◊ |
C |
x,y,z |
1_555 |
128 |
33 |
10926 |
1257.5 |
-18.6 |
0.057 |
9 |
2 |
0 |
0.602 |
Average: |
1269.0 |
-18.0 |
0.078 |
10 |
2 |
0 |
0.602 |
2 |
3 |
|
B |
61 |
19 |
10654 |
◊ |
C |
x-1,y,z-1 |
1_454 |
56 |
17 |
10926 |
540.2 |
-2.5 |
0.607 |
2 |
2 |
0 |
0.000 |
3 |
4 |
|
[93C]D:302 |
26 |
1 |
590 |
f |
D |
x,y,z |
1_555 |
55 |
16 |
10866 |
391.0 |
3.5 |
0.336 |
0 |
0 |
0 |
0.000 |
5 |
|
[93C]C:203 |
27 |
1 |
589 |
f |
C |
x,y,z |
1_555 |
55 |
16 |
10926 |
389.8 |
4.7 |
0.437 |
0 |
0 |
0 |
0.000 |
6 |
|
[93C]A:302 |
27 |
1 |
589 |
f |
A |
x,y,z |
1_555 |
51 |
15 |
10814 |
387.9 |
3.7 |
0.329 |
0 |
0 |
0 |
0.000 |
7 |
|
[93C]B:203 |
26 |
1 |
587 |
f |
B |
x,y,z |
1_555 |
52 |
14 |
10654 |
367.6 |
3.2 |
0.349 |
0 |
0 |
0 |
0.000 |
Average: |
384.1 |
3.8 |
0.363 |
0 |
0 |
0 |
0.000 |
4 |
8 |
|
[GSH]C:202 |
19 |
1 |
516 |
f |
C |
x,y,z |
1_555 |
45 |
17 |
10926 |
307.1 |
-3.1 |
0.726 |
7 |
0 |
0 |
0.347 |
9 |
|
[GSH]D:301 |
19 |
1 |
516 |
f |
D |
x,y,z |
1_555 |
44 |
15 |
10866 |
301.5 |
-3.9 |
0.642 |
7 |
0 |
0 |
0.347 |
10 |
|
[GSH]A:301 |
19 |
1 |
520 |
f |
A |
x,y,z |
1_555 |
43 |
16 |
10814 |
294.0 |
-4.0 |
0.618 |
7 |
0 |
0 |
0.347 |
Average: |
300.9 |
-3.7 |
0.662 |
7 |
0 |
0 |
0.347 |
5 |
11 |
|
[GSH]B:202 |
19 |
1 |
514 |
f |
B |
x,y,z |
1_555 |
43 |
16 |
10654 |
304.0 |
-3.6 |
0.721 |
9 |
0 |
0 |
0.193 |
6 |
12 |
|
D |
30 |
10 |
10866 |
◊ |
A |
x,y,z |
1_555 |
34 |
13 |
10814 |
285.5 |
2.4 |
0.846 |
6 |
2 |
0 |
0.000 |
13 |
|
A |
30 |
9 |
10814 |
◊ |
D |
x-1,y,z |
1_455 |
32 |
11 |
10866 |
279.1 |
2.7 |
0.852 |
3 |
3 |
0 |
0.000 |
Average: |
282.3 |
2.5 |
0.849 |
5 |
3 |
0 |
0.000 |
7 |
14 |
|
C |
28 |
10 |
10926 |
◊ |
D |
x,y-1,z |
1_545 |
28 |
9 |
10866 |
255.5 |
-1.0 |
0.507 |
2 |
1 |
0 |
0.000 |
15 |
|
A |
29 |
8 |
10814 |
◊ |
B |
x,y-1,z |
1_545 |
23 |
10 |
10654 |
238.2 |
-3.3 |
0.262 |
0 |
0 |
0 |
0.000 |
Average: |
246.9 |
-2.1 |
0.385 |
1 |
1 |
0 |
0.000 |
8 |
16 |
|
A |
21 |
6 |
10814 |
x |
A |
x-1,y,z |
1_455 |
30 |
10 |
10814 |
226.7 |
-0.7 |
0.398 |
2 |
2 |
0 |
0.000 |
17 |
|
D |
21 |
6 |
10866 |
x |
D |
x-1,y,z |
1_455 |
27 |
10 |
10866 |
218.5 |
-0.8 |
0.410 |
2 |
2 |
0 |
0.000 |
Average: |
222.6 |
-0.8 |
0.404 |
2 |
2 |
0 |
0.000 |
9 |
18 |
|
B |
20 |
6 |
10654 |
◊ |
C |
x,y,z-1 |
1_554 |
20 |
9 |
10926 |
176.7 |
1.4 |
0.787 |
0 |
1 |
0 |
0.000 |
10 |
19 |
|
C |
15 |
5 |
10926 |
◊ |
D |
x-1,y,z |
1_455 |
14 |
4 |
10866 |
167.2 |
-4.0 |
0.087 |
1 |
0 |
0 |
0.000 |
20 |
|
B |
15 |
5 |
10654 |
◊ |
A |
x-1,y,z |
1_455 |
14 |
4 |
10814 |
166.1 |
-3.9 |
0.099 |
1 |
0 |
0 |
0.000 |
Average: |
166.7 |
-3.9 |
0.093 |
1 |
0 |
0 |
0.000 |
11 |
21 |
|
D |
16 |
5 |
10866 |
x |
D |
x,y-1,z |
1_545 |
12 |
4 |
10866 |
148.0 |
-1.8 |
0.308 |
1 |
0 |
0 |
0.000 |
22 |
|
A |
13 |
4 |
10814 |
x |
A |
x,y-1,z |
1_545 |
16 |
5 |
10814 |
139.9 |
-2.1 |
0.257 |
0 |
0 |
0 |
0.000 |
Average: |
143.9 |
-1.9 |
0.282 |
1 |
0 |
0 |
0.000 |
12 |
23 |
|
C |
20 |
6 |
10926 |
x |
C |
x-1,y,z |
1_455 |
18 |
4 |
10926 |
142.2 |
-1.1 |
0.522 |
0 |
0 |
0 |
0.000 |
24 |
|
B |
13 |
4 |
10654 |
x |
B |
x-1,y,z |
1_455 |
12 |
2 |
10654 |
107.2 |
-1.7 |
0.278 |
0 |
0 |
0 |
0.000 |
Average: |
124.7 |
-1.4 |
0.400 |
0 |
0 |
0 |
0.000 |
13 |
25 |
|
[GOL]D:303 |
6 |
1 |
217 |
f |
D |
x,y,z |
1_555 |
15 |
5 |
10866 |
104.0 |
-1.0 |
0.466 |
2 |
0 |
0 |
0.049 |
14 |
26 |
|
[GOL]A:304 |
6 |
1 |
219 |
◊ |
D |
x-1,y,z |
1_455 |
18 |
5 |
10866 |
98.2 |
0.8 |
0.745 |
4 |
0 |
0 |
0.000 |
15 |
27 |
|
[GOL]A:303 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
10814 |
96.1 |
0.7 |
0.742 |
4 |
0 |
0 |
0.028 |
16 |
28 |
|
[93C]A:302 |
11 |
1 |
589 |
f |
[GSH]A:301 |
x,y,z |
1_555 |
8 |
1 |
520 |
87.0 |
-3.7 |
0.090 |
1 |
0 |
0 |
0.107 |
29 |
|
[93C]D:302 |
12 |
1 |
590 |
f |
[GSH]D:301 |
x,y,z |
1_555 |
8 |
1 |
516 |
87.0 |
-3.6 |
0.097 |
1 |
0 |
0 |
0.107 |
Average: |
87.0 |
-3.7 |
0.094 |
1 |
0 |
0 |
0.107 |
17 |
30 |
|
C |
14 |
4 |
10926 |
x |
C |
x,y-1,z |
1_545 |
12 |
3 |
10926 |
85.6 |
-0.7 |
0.441 |
2 |
0 |
0 |
0.000 |
31 |
|
B |
11 |
3 |
10654 |
x |
B |
x,y-1,z |
1_545 |
11 |
3 |
10654 |
81.4 |
-0.9 |
0.396 |
2 |
0 |
0 |
0.000 |
Average: |
83.5 |
-0.8 |
0.419 |
2 |
0 |
0 |
0.000 |
18 |
32 |
|
[93C]C:203 |
10 |
1 |
589 |
f |
[GSH]C:202 |
x,y,z |
1_555 |
7 |
1 |
516 |
82.4 |
-3.2 |
0.102 |
1 |
0 |
0 |
0.097 |
33 |
|
[93C]B:203 |
8 |
1 |
587 |
f |
[GSH]B:202 |
x,y,z |
1_555 |
5 |
1 |
514 |
51.7 |
-2.0 |
0.170 |
1 |
0 |
0 |
0.097 |
Average: |
67.1 |
-2.6 |
0.136 |
1 |
0 |
0 |
0.097 |
19 |
34 |
|
A |
9 |
5 |
10814 |
◊ |
D |
x-1,y+1,z |
1_465 |
9 |
4 |
10866 |
82.1 |
-0.8 |
0.422 |
0 |
0 |
0 |
0.000 |
35 |
|
D |
9 |
5 |
10866 |
◊ |
A |
x,y-1,z |
1_545 |
11 |
5 |
10814 |
72.3 |
-1.2 |
0.365 |
0 |
0 |
0 |
0.000 |
Average: |
77.2 |
-1.0 |
0.393 |
0 |
0 |
0 |
0.000 |
20 |
36 |
|
[GOL]A:304 |
5 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
13 |
3 |
10814 |
80.2 |
-0.7 |
0.515 |
1 |
0 |
0 |
0.028 |
21 |
37 |
|
[GOL]A:303 |
6 |
1 |
219 |
◊ |
D |
x,y,z |
1_555 |
13 |
3 |
10866 |
75.2 |
-0.6 |
0.515 |
1 |
0 |
0 |
0.000 |
22 |
38 |
|
[93C]A:302 |
2 |
1 |
589 |
◊ |
B |
x,y-1,z |
1_545 |
7 |
3 |
10654 |
49.6 |
0.2 |
0.512 |
0 |
0 |
0 |
0.000 |
39 |
|
C |
7 |
3 |
10926 |
◊ |
[93C]D:302 |
x,y-1,z |
1_545 |
2 |
1 |
590 |
46.0 |
0.2 |
0.486 |
0 |
0 |
0 |
0.000 |
Average: |
47.8 |
0.2 |
0.499 |
0 |
0 |
0 |
0.000 |
23 |
40 |
|
[MG]B:201 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
10654 |
42.0 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.187 |
41 |
|
[MG]C:201 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
10926 |
41.7 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.187 |
42 |
|
[MG]B:201 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
10814 |
41.5 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.187 |
43 |
|
[MG]C:201 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
9 |
4 |
10866 |
41.2 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.187 |
Average: |
41.6 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.187 |
24 |
44 |
|
[GOL]D:303 |
4 |
1 |
217 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
10814 |
41.3 |
1.4 |
0.817 |
2 |
0 |
0 |
0.000 |
25 |
45 |
|
[GSH]C:202 |
3 |
1 |
516 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
10866 |
38.9 |
0.2 |
0.710 |
1 |
0 |
0 |
0.006 |
46 |
|
[GSH]B:202 |
3 |
1 |
514 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
10814 |
38.4 |
0.2 |
0.720 |
1 |
0 |
0 |
0.006 |
Average: |
38.6 |
0.2 |
0.715 |
1 |
0 |
0 |
0.006 |
26 |
47 |
|
[GSH]D:301 |
3 |
1 |
516 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
10926 |
38.5 |
0.2 |
0.718 |
1 |
0 |
0 |
0.007 |
48 |
|
[GSH]A:301 |
3 |
1 |
520 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
10654 |
37.5 |
0.2 |
0.724 |
1 |
0 |
0 |
0.007 |
Average: |
38.0 |
0.2 |
0.721 |
1 |
0 |
0 |
0.007 |
27 |
49 |
|
[GOL]D:303 |
2 |
1 |
217 |
◊ |
[GOL]A:303 |
x,y,z |
1_555 |
2 |
1 |
219 |
27.3 |
-0.3 |
0.583 |
0 |
0 |
0 |
0.000 |
28 |
50 |
|
[GSH]A:301 |
1 |
1 |
520 |
◊ |
B |
x,y-1,z |
1_545 |
4 |
2 |
10654 |
16.9 |
-1.0 |
0.260 |
0 |
0 |
0 |
0.000 |
51 |
|
C |
4 |
2 |
10926 |
◊ |
[GSH]D:301 |
x,y-1,z |
1_545 |
1 |
1 |
516 |
14.9 |
-0.8 |
0.324 |
0 |
0 |
0 |
0.000 |
Average: |
15.9 |
-0.9 |
0.292 |
0 |
0 |
0 |
0.000 |
29 |
52 |
|
C |
1 |
1 |
10926 |
◊ |
B |
x,y-1,z+1 |
1_546 |
1 |
1 |
10654 |
2.4 |
0.1 |
0.746 |
0 |
0 |
0 |
0.000 |
|