| ## |
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 |
|
A |
143 |
47 |
10610 |
◊ |
D |
-x+1/2,-y+1,z-1/2 |
2_564 |
133 |
41 |
10782 |
1282.8 |
-9.0 |
0.378 |
13 |
0 |
0 |
0.291 |
2 |
|
C |
127 |
40 |
10721 |
◊ |
B |
x,y,z |
1_555 |
138 |
43 |
10841 |
1258.5 |
-6.8 |
0.451 |
13 |
0 |
0 |
0.291 |
| Average: |
1270.7 |
-7.9 |
0.415 |
13 |
0 |
0 |
0.291 |
| 2 |
3 |
|
D |
81 |
28 |
10782 |
◊ |
B |
-x,y-1/2,-z+3/2 |
3_546 |
88 |
25 |
10841 |
779.1 |
-0.1 |
0.750 |
9 |
0 |
0 |
0.000 |
| 3 |
4 |
|
B |
52 |
18 |
10841 |
◊ |
A |
x,y,z |
1_555 |
55 |
18 |
10610 |
539.6 |
-7.2 |
0.176 |
10 |
0 |
0 |
0.239 |
5 |
|
D |
54 |
18 |
10782 |
◊ |
C |
x,y,z |
1_555 |
59 |
18 |
10721 |
510.5 |
-7.7 |
0.155 |
10 |
0 |
0 |
0.239 |
| Average: |
525.0 |
-7.5 |
0.166 |
10 |
0 |
0 |
0.239 |
| 4 |
6 |
|
B |
54 |
18 |
10841 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
53 |
12 |
10610 |
483.5 |
-3.2 |
0.470 |
7 |
3 |
0 |
0.000 |
| 5 |
7 |
|
A |
46 |
12 |
10610 |
x |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
46 |
10 |
10610 |
345.7 |
2.7 |
0.862 |
5 |
1 |
0 |
0.000 |
| 6 |
8 |
|
A |
35 |
10 |
10610 |
◊ |
C |
x-1/2,-y+1/2,-z+1 |
4_456 |
38 |
12 |
10721 |
339.3 |
-1.4 |
0.531 |
7 |
0 |
0 |
0.000 |
| 7 |
9 |
|
C |
30 |
10 |
10721 |
x |
C |
-x+1,y-1/2,-z+3/2 |
3_646 |
28 |
9 |
10721 |
260.9 |
1.0 |
0.757 |
4 |
3 |
0 |
0.000 |
| 8 |
10 |
|
[GOL]A:328 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
25 |
10 |
10610 |
134.3 |
0.1 |
0.629 |
7 |
0 |
0 |
0.061 |
| 9 |
11 |
|
[GOL]D:329 |
6 |
1 |
219 |
f |
D |
x,y,z |
1_555 |
21 |
6 |
10782 |
123.1 |
-0.1 |
0.590 |
4 |
0 |
0 |
0.037 |
| 10 |
12 |
|
A |
13 |
5 |
10610 |
◊ |
[GOL]A:330 |
x-1/2,-y+1/2,-z+1 |
4_456 |
6 |
1 |
215 |
90.9 |
-0.7 |
0.493 |
1 |
0 |
0 |
0.000 |
| 11 |
13 |
|
[FMT]C:323 |
3 |
1 |
149 |
f |
C |
x,y,z |
1_555 |
13 |
4 |
10721 |
85.8 |
-0.7 |
0.320 |
1 |
0 |
0 |
0.026 |
| 12 |
14 |
|
[GOL]A:330 |
6 |
1 |
215 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
10610 |
84.8 |
0.2 |
0.621 |
3 |
0 |
0 |
0.024 |
| 13 |
15 |
|
[FMT]C:310 |
3 |
1 |
149 |
f |
C |
x,y,z |
1_555 |
11 |
7 |
10721 |
84.3 |
0.1 |
0.416 |
3 |
0 |
0 |
0.056 |
16 |
|
[FMT]D:312 |
3 |
1 |
148 |
f |
D |
x,y,z |
1_555 |
11 |
7 |
10782 |
83.1 |
0.1 |
0.412 |
4 |
0 |
0 |
0.056 |
| Average: |
83.7 |
0.1 |
0.414 |
4 |
0 |
0 |
0.056 |
| 14 |
17 |
|
[FMT]C:319 |
3 |
1 |
149 |
f |
C |
x,y,z |
1_555 |
16 |
4 |
10721 |
84.0 |
-0.4 |
0.559 |
2 |
0 |
0 |
0.030 |
| 15 |
18 |
|
[FMT]A:306 |
3 |
1 |
149 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
10610 |
83.4 |
0.0 |
0.414 |
4 |
0 |
0 |
0.036 |
| 16 |
19 |
|
[FMT]A:315 |
3 |
1 |
149 |
f |
A |
x,y,z |
1_555 |
14 |
4 |
10610 |
80.1 |
-0.0 |
0.402 |
3 |
0 |
0 |
0.028 |
| 17 |
20 |
|
A |
14 |
4 |
10610 |
◊ |
[GOL]A:331 |
x-1/2,-y+1/2,-z+1 |
4_456 |
5 |
1 |
222 |
78.7 |
0.1 |
0.566 |
1 |
0 |
0 |
0.000 |
| 18 |
21 |
|
[GOL]A:331 |
5 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
10610 |
78.2 |
0.2 |
0.595 |
3 |
0 |
0 |
0.022 |
| 19 |
22 |
|
B |
8 |
3 |
10841 |
◊ |
D |
-x+1/2,-y+1,z-1/2 |
2_564 |
7 |
3 |
10782 |
77.3 |
0.4 |
0.705 |
2 |
0 |
0 |
0.000 |
| 20 |
23 |
|
[FMT]C:325 |
3 |
1 |
148 |
f |
C |
x,y,z |
1_555 |
10 |
4 |
10721 |
76.3 |
0.5 |
0.721 |
3 |
0 |
0 |
0.019 |
| 21 |
24 |
|
[FMT]B:308 |
3 |
1 |
148 |
f |
B |
x,y,z |
1_555 |
10 |
7 |
10841 |
75.3 |
0.0 |
0.415 |
3 |
0 |
0 |
0.030 |
| 22 |
25 |
|
[GOL]C:326 |
6 |
1 |
220 |
f |
C |
x,y,z |
1_555 |
9 |
5 |
10721 |
75.0 |
0.0 |
0.637 |
4 |
0 |
0 |
0.041 |
| 23 |
26 |
|
[GOL]D:327 |
6 |
1 |
219 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
10782 |
74.7 |
-0.0 |
0.629 |
3 |
0 |
0 |
0.027 |
| 24 |
27 |
|
[FMT]C:313 |
3 |
1 |
148 |
◊ |
C |
x,y,z |
1_555 |
10 |
5 |
10721 |
72.4 |
0.4 |
0.654 |
1 |
0 |
0 |
0.000 |
| 25 |
28 |
|
[GOL]D:327 |
5 |
1 |
219 |
◊ |
C |
x,y,z |
1_555 |
15 |
6 |
10721 |
68.7 |
-0.1 |
0.558 |
2 |
0 |
0 |
0.019 |
| 26 |
29 |
|
A |
7 |
4 |
10610 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
6 |
3 |
10721 |
67.1 |
0.9 |
0.772 |
3 |
0 |
0 |
0.000 |
30 |
|
D |
7 |
4 |
10782 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
10841 |
66.8 |
0.2 |
0.648 |
0 |
0 |
0 |
0.000 |
31 |
|
C |
8 |
3 |
10721 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
10610 |
54.1 |
-0.4 |
0.567 |
0 |
0 |
0 |
0.000 |
| Average: |
62.7 |
0.2 |
0.662 |
1 |
0 |
0 |
0.000 |
| 27 |
32 |
|
[GOL]C:326 |
5 |
1 |
220 |
◊ |
D |
x,y,z |
1_555 |
13 |
5 |
10782 |
67.0 |
-0.1 |
0.614 |
1 |
0 |
0 |
0.009 |
| 28 |
33 |
|
[FMT]D:320 |
3 |
1 |
148 |
◊ |
D |
x,y,z |
1_555 |
11 |
5 |
10782 |
61.5 |
0.0 |
0.405 |
1 |
0 |
0 |
0.008 |
| 29 |
34 |
|
[FMT]A:314 |
3 |
1 |
149 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
10610 |
60.9 |
-0.4 |
0.576 |
0 |
0 |
0 |
0.008 |
| 30 |
35 |
|
[NA]B:303 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
10841 |
60.4 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.360 |
36 |
|
[NA]A:301 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
10610 |
60.3 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.360 |
37 |
|
[NA]D:304 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
13 |
6 |
10782 |
47.8 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.360 |
38 |
|
[NA]C:302 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
11 |
6 |
10721 |
46.8 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.360 |
| Average: |
53.8 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.360 |
| 31 |
39 |
|
[FMT]B:307 |
3 |
1 |
148 |
f |
C |
x,y,z |
1_555 |
10 |
3 |
10721 |
60.1 |
-0.2 |
0.411 |
2 |
0 |
0 |
0.025 |
| 32 |
40 |
|
C |
6 |
3 |
10721 |
◊ |
D |
-x+1,y-1/2,-z+3/2 |
3_646 |
5 |
2 |
10782 |
60.0 |
-1.6 |
0.177 |
0 |
0 |
0 |
0.000 |
| 33 |
41 |
|
A |
7 |
3 |
10610 |
f |
[FMT]D:311 |
-x+1/2,-y+1,z-1/2 |
2_564 |
3 |
1 |
149 |
59.4 |
-0.8 |
0.296 |
1 |
0 |
0 |
0.024 |
| 34 |
42 |
|
[FMT]C:309 |
3 |
1 |
149 |
◊ |
B |
x,y,z |
1_555 |
11 |
3 |
10841 |
59.4 |
-0.1 |
0.405 |
1 |
0 |
0 |
0.012 |
| 35 |
43 |
|
[FMT]A:305 |
3 |
1 |
149 |
◊ |
A |
x,y,z |
1_555 |
10 |
6 |
10610 |
59.2 |
-0.2 |
0.571 |
1 |
0 |
0 |
0.013 |
| 36 |
44 |
|
[FMT]B:307 |
3 |
1 |
148 |
◊ |
B |
x,y,z |
1_555 |
11 |
7 |
10841 |
58.9 |
-0.2 |
0.561 |
1 |
0 |
0 |
0.014 |
| 37 |
45 |
|
[FMT]A:305 |
3 |
1 |
149 |
f |
D |
-x+1/2,-y+1,z-1/2 |
2_564 |
9 |
3 |
10782 |
58.7 |
0.1 |
0.411 |
2 |
0 |
0 |
0.015 |
| 38 |
46 |
|
A |
10 |
3 |
10610 |
f |
[FMT]D:320 |
-x+1/2,-y+1,z-1/2 |
2_564 |
3 |
1 |
148 |
58.3 |
-0.3 |
0.547 |
1 |
0 |
0 |
0.015 |
| 39 |
47 |
|
[FMT]D:311 |
3 |
1 |
149 |
◊ |
D |
x,y,z |
1_555 |
12 |
7 |
10782 |
57.4 |
-0.1 |
0.569 |
1 |
0 |
0 |
0.011 |
| 40 |
48 |
|
[FMT]C:309 |
3 |
1 |
149 |
f |
C |
x,y,z |
1_555 |
11 |
6 |
10721 |
57.1 |
-0.2 |
0.572 |
1 |
0 |
0 |
0.014 |
| 41 |
49 |
|
[FMT]A:317 |
3 |
1 |
149 |
f |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
9 |
4 |
10610 |
56.4 |
-0.1 |
0.389 |
1 |
0 |
0 |
0.010 |
| 42 |
50 |
|
[FMT]A:316 |
3 |
1 |
148 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
10841 |
55.0 |
-0.4 |
0.399 |
0 |
0 |
0 |
0.009 |
| 43 |
51 |
|
[FMT]A:316 |
3 |
1 |
148 |
◊ |
A |
x,y,z |
1_555 |
4 |
3 |
10610 |
54.1 |
0.4 |
0.463 |
1 |
0 |
0 |
0.000 |
| 44 |
52 |
|
[FMT]A:324 |
3 |
1 |
148 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
10610 |
51.9 |
0.9 |
0.773 |
1 |
0 |
0 |
0.000 |
| 45 |
53 |
|
[FMT]C:318 |
3 |
1 |
149 |
f |
C |
x,y,z |
1_555 |
6 |
5 |
10721 |
51.0 |
0.2 |
0.636 |
1 |
0 |
0 |
0.007 |
| 46 |
54 |
|
[FMT]D:322 |
3 |
1 |
149 |
f |
C |
x,y,z |
1_555 |
9 |
4 |
10721 |
50.6 |
0.2 |
0.651 |
1 |
0 |
0 |
0.005 |
| 47 |
55 |
|
[FMT]D:322 |
3 |
1 |
149 |
◊ |
D |
x,y,z |
1_555 |
4 |
3 |
10782 |
48.3 |
0.3 |
0.468 |
0 |
0 |
0 |
0.000 |
| 48 |
56 |
|
[FMT]C:321 |
3 |
1 |
148 |
◊ |
D |
x,y,z |
1_555 |
9 |
4 |
10782 |
47.8 |
0.1 |
0.648 |
1 |
0 |
0 |
0.006 |
| 49 |
57 |
|
[FMT]C:321 |
3 |
1 |
148 |
f |
C |
x,y,z |
1_555 |
4 |
3 |
10721 |
47.1 |
0.5 |
0.466 |
1 |
0 |
0 |
0.000 |
| 50 |
58 |
|
[FMT]A:317 |
2 |
1 |
149 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
10610 |
44.9 |
0.3 |
0.631 |
1 |
0 |
0 |
0.000 |
| 51 |
59 |
|
[FMT]C:325 |
3 |
1 |
148 |
◊ |
C |
-x+1,y-1/2,-z+3/2 |
3_646 |
9 |
3 |
10721 |
43.4 |
-0.6 |
0.376 |
0 |
0 |
0 |
0.000 |
| 52 |
60 |
|
[GOL]A:331 |
4 |
1 |
222 |
f |
[FMT]A:324 |
x,y,z |
1_555 |
2 |
1 |
148 |
40.1 |
-0.1 |
0.599 |
1 |
0 |
0 |
0.011 |
| 53 |
61 |
|
[FMT]A:314 |
3 |
1 |
149 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
1 |
10610 |
40.0 |
1.1 |
0.816 |
2 |
0 |
0 |
0.000 |
| 54 |
62 |
|
[NA]B:303 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
10610 |
31.9 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.145 |
63 |
|
[NA]A:301 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
10841 |
31.4 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.145 |
64 |
|
[NA]D:304 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
7 |
4 |
10721 |
24.3 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.145 |
65 |
|
[NA]C:302 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
6 |
4 |
10782 |
23.4 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.145 |
| Average: |
27.8 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.145 |
| 55 |
66 |
|
D |
5 |
3 |
10782 |
◊ |
C |
-x+1,y-1/2,-z+3/2 |
3_646 |
6 |
2 |
10721 |
31.5 |
-0.5 |
0.479 |
0 |
0 |
0 |
0.000 |
| 56 |
67 |
|
[GOL]C:326 |
3 |
1 |
220 |
f |
[NA]C:302 |
x,y,z |
1_555 |
1 |
1 |
125 |
30.6 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.071 |
| 57 |
68 |
|
[GOL]D:327 |
4 |
1 |
219 |
f |
[NA]D:304 |
x,y,z |
1_555 |
1 |
1 |
125 |
29.7 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.055 |
| 58 |
69 |
|
[GOL]C:326 |
4 |
1 |
220 |
f |
[FMT]C:321 |
x,y,z |
1_555 |
2 |
1 |
148 |
29.0 |
-0.6 |
0.511 |
0 |
0 |
0 |
0.013 |
| 59 |
70 |
|
[FMT]C:313 |
2 |
1 |
148 |
f |
C |
-x+1,y-1/2,-z+3/2 |
3_646 |
4 |
2 |
10721 |
27.6 |
-0.4 |
0.494 |
0 |
0 |
0 |
0.009 |
| 60 |
71 |
|
[FMT]A:324 |
3 |
1 |
148 |
f |
[FMT]A:315 |
x,y,z |
1_555 |
3 |
1 |
149 |
26.3 |
0.4 |
0.427 |
0 |
0 |
0 |
0.000 |
| 61 |
72 |
|
[GOL]D:327 |
3 |
1 |
219 |
◊ |
[FMT]D:322 |
x,y,z |
1_555 |
2 |
1 |
149 |
25.8 |
-0.2 |
0.505 |
0 |
0 |
0 |
0.004 |
| 62 |
73 |
|
[FMT]B:308 |
3 |
1 |
148 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
1 |
10610 |
25.5 |
0.7 |
0.801 |
1 |
0 |
0 |
0.000 |
| 63 |
74 |
|
[GOL]A:328 |
3 |
1 |
221 |
◊ |
D |
-x+1/2,-y+1,z-1/2 |
2_564 |
1 |
1 |
10782 |
19.3 |
0.4 |
0.685 |
0 |
0 |
0 |
0.000 |
| 64 |
75 |
|
A |
2 |
2 |
10610 |
◊ |
[FMT]A:324 |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
1 |
148 |
18.0 |
0.6 |
0.720 |
0 |
0 |
0 |
0.000 |
| 65 |
76 |
|
[FMT]A:317 |
2 |
1 |
149 |
◊ |
C |
x-1/2,-y+1/2,-z+1 |
4_456 |
3 |
2 |
10721 |
16.1 |
0.1 |
0.642 |
0 |
0 |
0 |
0.000 |
| 66 |
77 |
|
A |
2 |
1 |
10610 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
3 |
2 |
10841 |
12.7 |
-0.4 |
0.392 |
0 |
0 |
0 |
0.000 |
| 67 |
78 |
|
B |
1 |
1 |
10841 |
◊ |
[FMT]D:320 |
-x+1/2,-y+1,z-1/2 |
2_564 |
1 |
1 |
148 |
2.7 |
-0.0 |
0.381 |
0 |
0 |
0 |
0.000 |
| 68 |
79 |
|
[GOL]A:331 |
1 |
1 |
222 |
f |
[GOL]A:330 |
x,y,z |
1_555 |
1 |
1 |
215 |
2.3 |
0.1 |
0.500 |
0 |
0 |
0 |
0.000 |
| 69 |
80 |
|
[GOL]A:328 |
1 |
1 |
221 |
◊ |
C |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
10721 |
1.0 |
0.0 |
0.588 |
0 |
0 |
0 |
0.000 |
|