| ## |
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 |
152 |
40 |
17669 |
◊ |
C |
-x,y-1/2,-z-1 |
2_544 |
152 |
40 |
17491 |
1514.0 |
-9.6 |
0.232 |
22 |
8 |
0 |
0.500 |
2 |
|
D |
156 |
40 |
17476 |
◊ |
A |
-x-1,y-1/2,-z-1 |
2_444 |
151 |
40 |
17656 |
1495.4 |
-10.3 |
0.205 |
22 |
8 |
0 |
0.500 |
| Average: |
1504.7 |
-9.9 |
0.219 |
22 |
8 |
0 |
0.500 |
| 2 |
3 |
|
B |
33 |
7 |
17669 |
◊ |
A |
x,y,z |
1_555 |
35 |
10 |
17656 |
304.5 |
-2.7 |
0.181 |
1 |
0 |
0 |
0.000 |
4 |
|
B |
26 |
8 |
17669 |
◊ |
A |
x,y-1,z |
1_545 |
30 |
8 |
17656 |
236.1 |
-2.7 |
0.250 |
1 |
0 |
0 |
0.000 |
| Average: |
270.3 |
-2.7 |
0.215 |
1 |
0 |
0 |
0.000 |
| 3 |
5 |
|
C |
40 |
17 |
17491 |
◊ |
A |
x,y,z-1 |
1_554 |
30 |
8 |
17656 |
295.7 |
-1.9 |
0.393 |
3 |
0 |
0 |
0.000 |
6 |
|
D |
30 |
11 |
17476 |
◊ |
B |
x,y,z |
1_555 |
26 |
7 |
17669 |
232.8 |
-0.3 |
0.359 |
1 |
0 |
0 |
0.000 |
| Average: |
264.3 |
-1.1 |
0.376 |
2 |
0 |
0 |
0.000 |
| 4 |
7 |
|
D |
36 |
15 |
17476 |
◊ |
B |
x,y,z-1 |
1_554 |
41 |
12 |
17669 |
290.4 |
0.2 |
0.668 |
4 |
1 |
0 |
0.000 |
8 |
|
C |
34 |
14 |
17491 |
◊ |
A |
x,y,z |
1_555 |
40 |
12 |
17656 |
289.4 |
1.0 |
0.748 |
4 |
2 |
0 |
0.000 |
| Average: |
289.9 |
0.6 |
0.708 |
4 |
2 |
0 |
0.000 |
| 5 |
9 |
|
D |
35 |
11 |
17476 |
◊ |
C |
x,y-1,z |
1_545 |
42 |
14 |
17491 |
274.2 |
1.0 |
0.731 |
4 |
2 |
0 |
0.000 |
10 |
|
D |
43 |
15 |
17476 |
◊ |
C |
x,y,z |
1_555 |
36 |
10 |
17491 |
273.9 |
-0.6 |
0.579 |
2 |
1 |
0 |
0.000 |
| Average: |
274.1 |
0.2 |
0.655 |
3 |
2 |
0 |
0.000 |
| 6 |
11 |
|
[BG6]B:501 |
16 |
1 |
384 |
f |
B |
x,y,z |
1_555 |
39 |
16 |
17669 |
260.9 |
-4.4 |
0.320 |
8 |
0 |
0 |
0.174 |
12 |
|
[BG6]A:501 |
16 |
1 |
381 |
f |
A |
x,y,z |
1_555 |
34 |
15 |
17656 |
258.4 |
-4.0 |
0.306 |
6 |
0 |
0 |
0.174 |
| Average: |
259.6 |
-4.2 |
0.313 |
7 |
0 |
0 |
0.174 |
| 7 |
13 |
|
[0WK]D:503 |
15 |
1 |
368 |
f |
D |
x,y,z |
1_555 |
32 |
14 |
17476 |
238.7 |
-3.9 |
0.291 |
6 |
0 |
0 |
0.154 |
14 |
|
[0WK]C:506 |
14 |
1 |
369 |
f |
C |
x,y,z |
1_555 |
36 |
16 |
17491 |
237.1 |
-3.1 |
0.316 |
5 |
0 |
0 |
0.154 |
| Average: |
237.9 |
-3.5 |
0.304 |
6 |
0 |
0 |
0.154 |
| 8 |
15 |
|
[BGC]C:507 |
12 |
1 |
306 |
f |
C |
x,y,z |
1_555 |
25 |
11 |
17491 |
171.6 |
1.4 |
0.242 |
0 |
0 |
0 |
0.000 |
16 |
|
[BGC]D:504 |
12 |
1 |
303 |
f |
D |
x,y,z |
1_555 |
23 |
12 |
17476 |
169.4 |
1.5 |
0.206 |
1 |
0 |
0 |
0.000 |
| Average: |
170.5 |
1.5 |
0.224 |
1 |
0 |
0 |
0.000 |
| 9 |
17 |
|
B |
25 |
9 |
17669 |
◊ |
C |
-x-1,y-1/2,-z-1 |
2_444 |
22 |
8 |
17491 |
149.4 |
1.4 |
0.773 |
0 |
0 |
0 |
0.000 |
| 10 |
18 |
|
[GOL]A:505 |
6 |
1 |
223 |
f |
A |
x,y,z |
1_555 |
23 |
7 |
17656 |
143.9 |
-1.4 |
0.331 |
0 |
0 |
0 |
0.034 |
| 11 |
19 |
|
[GOL]B:502 |
6 |
1 |
222 |
f |
B |
x,y,z |
1_555 |
20 |
6 |
17669 |
128.1 |
-1.1 |
0.373 |
0 |
0 |
0 |
0.025 |
| 12 |
20 |
|
[GOL]B:503 |
6 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
19 |
5 |
17669 |
120.5 |
-0.6 |
0.550 |
4 |
0 |
0 |
0.052 |
| 13 |
21 |
|
[GOL]D:501 |
6 |
1 |
219 |
f |
D |
x,y,z |
1_555 |
20 |
5 |
17476 |
119.7 |
-0.7 |
0.489 |
3 |
0 |
0 |
0.097 |
22 |
|
[GOL]A:502 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
20 |
5 |
17656 |
118.0 |
-0.8 |
0.488 |
3 |
0 |
0 |
0.097 |
| Average: |
118.8 |
-0.7 |
0.489 |
3 |
0 |
0 |
0.097 |
| 14 |
23 |
|
D |
19 |
7 |
17476 |
◊ |
A |
-x,y-1/2,-z-1 |
2_544 |
14 |
8 |
17656 |
119.3 |
1.7 |
0.766 |
0 |
0 |
0 |
0.000 |
| 15 |
24 |
|
[GOL]C:503 |
6 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
18 |
4 |
17491 |
117.2 |
-0.7 |
0.494 |
3 |
0 |
0 |
0.044 |
| 16 |
25 |
|
[GOL]A:506 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
25 |
9 |
17656 |
115.2 |
-1.2 |
0.432 |
1 |
0 |
0 |
0.039 |
| 17 |
26 |
|
[GOL]C:504 |
6 |
1 |
221 |
f |
C |
x,y,z |
1_555 |
17 |
7 |
17491 |
110.6 |
-0.8 |
0.436 |
2 |
0 |
0 |
0.037 |
| 18 |
27 |
|
[IMD]A:507 |
5 |
1 |
200 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
17656 |
86.7 |
2.9 |
0.243 |
1 |
0 |
0 |
0.000 |
| 19 |
28 |
|
D |
9 |
4 |
17476 |
◊ |
B |
-x,y-1/2,-z-1 |
2_544 |
8 |
3 |
17669 |
80.9 |
1.9 |
0.828 |
1 |
2 |
0 |
0.000 |
29 |
|
C |
8 |
4 |
17491 |
◊ |
A |
-x-1,y-1/2,-z-1 |
2_444 |
6 |
3 |
17656 |
63.7 |
1.5 |
0.738 |
1 |
1 |
0 |
0.000 |
| Average: |
72.3 |
1.7 |
0.783 |
1 |
2 |
0 |
0.000 |
| 20 |
30 |
|
[IMD]D:502 |
5 |
1 |
197 |
◊ |
C |
x,y-1,z |
1_545 |
10 |
4 |
17491 |
80.6 |
3.0 |
0.248 |
0 |
0 |
0 |
0.000 |
| 21 |
31 |
|
[IMD]D:502 |
5 |
1 |
197 |
f |
D |
x,y,z |
1_555 |
14 |
5 |
17476 |
78.8 |
2.5 |
0.218 |
1 |
0 |
0 |
0.000 |
| 22 |
32 |
|
[GOL]C:502 |
4 |
1 |
222 |
f |
C |
x,y,z |
1_555 |
14 |
2 |
17491 |
75.1 |
-1.8 |
0.218 |
0 |
0 |
0 |
0.085 |
33 |
|
D |
16 |
3 |
17476 |
f |
[GOL]A:504 |
-x-1,y-1/2,-z-1 |
2_444 |
4 |
1 |
221 |
72.6 |
-1.8 |
0.245 |
0 |
0 |
0 |
0.085 |
34 |
|
B |
14 |
2 |
17669 |
f |
[GOL]C:501 |
-x,y-1/2,-z-1 |
2_544 |
5 |
1 |
221 |
72.3 |
-1.8 |
0.258 |
0 |
0 |
0 |
0.085 |
35 |
|
[GOL]A:503 |
4 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
14 |
2 |
17656 |
70.9 |
-1.8 |
0.241 |
0 |
0 |
0 |
0.085 |
| Average: |
72.7 |
-1.8 |
0.240 |
0 |
0 |
0 |
0.085 |
| 23 |
36 |
|
D |
9 |
3 |
17476 |
◊ |
[GOL]A:506 |
-x-1,y-1/2,-z-1 |
2_444 |
6 |
1 |
220 |
72.0 |
0.7 |
0.715 |
3 |
0 |
0 |
0.016 |
| 24 |
37 |
|
D |
10 |
5 |
17476 |
◊ |
[GOL]A:503 |
-x-1,y-1/2,-z-1 |
2_444 |
4 |
1 |
219 |
70.8 |
0.2 |
0.640 |
3 |
0 |
0 |
0.052 |
38 |
|
[GOL]A:504 |
5 |
1 |
221 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
17656 |
70.7 |
0.2 |
0.609 |
3 |
0 |
0 |
0.052 |
39 |
|
[GOL]C:501 |
5 |
1 |
221 |
◊ |
C |
x,y,z |
1_555 |
9 |
4 |
17491 |
70.6 |
0.2 |
0.606 |
3 |
0 |
0 |
0.052 |
40 |
|
B |
9 |
4 |
17669 |
◊ |
[GOL]C:502 |
-x,y-1/2,-z-1 |
2_544 |
4 |
1 |
222 |
69.4 |
0.2 |
0.604 |
3 |
0 |
0 |
0.052 |
| Average: |
70.4 |
0.2 |
0.615 |
3 |
0 |
0 |
0.052 |
| 25 |
41 |
|
[BGC]C:507 |
7 |
1 |
306 |
cf |
[0WK]C:506 |
x,y,z |
1_555 |
9 |
1 |
369 |
67.8 |
0.7 |
0.235 |
0 |
0 |
0 |
0.000 |
| 26 |
42 |
|
[BGC]D:504 |
6 |
1 |
303 |
cf |
[0WK]D:503 |
x,y,z |
1_555 |
9 |
1 |
368 |
64.4 |
0.6 |
0.184 |
0 |
0 |
0 |
0.000 |
| 27 |
43 |
|
[GOL]B:502 |
4 |
1 |
222 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
17656 |
61.8 |
-0.7 |
0.404 |
0 |
0 |
0 |
0.000 |
| 28 |
44 |
|
[IMD]C:505 |
5 |
1 |
198 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
17491 |
59.7 |
1.8 |
0.106 |
0 |
0 |
0 |
0.000 |
| 29 |
45 |
|
D |
8 |
3 |
17476 |
f |
[IMD]A:507 |
-x,y-1/2,-z-1 |
2_544 |
5 |
1 |
200 |
58.1 |
1.8 |
0.124 |
0 |
0 |
0 |
0.000 |
| 30 |
46 |
|
D |
9 |
2 |
17476 |
◊ |
[GOL]C:504 |
x,y-1,z |
1_545 |
3 |
1 |
221 |
49.8 |
-0.4 |
0.504 |
0 |
0 |
0 |
0.000 |
| 31 |
47 |
|
B |
7 |
3 |
17669 |
◊ |
[GOL]A:505 |
x,y-1,z |
1_545 |
5 |
1 |
223 |
48.5 |
-0.2 |
0.526 |
0 |
0 |
0 |
0.000 |
| 32 |
48 |
|
[GOL]A:504 |
4 |
1 |
221 |
◊ |
[GOL]A:503 |
x,y,z |
1_555 |
5 |
1 |
219 |
41.7 |
-0.3 |
0.484 |
1 |
0 |
0 |
0.018 |
49 |
|
[GOL]C:502 |
4 |
1 |
222 |
◊ |
[GOL]C:501 |
x,y,z |
1_555 |
5 |
1 |
221 |
41.6 |
-0.3 |
0.484 |
1 |
0 |
0 |
0.018 |
| Average: |
41.7 |
-0.3 |
0.484 |
1 |
0 |
0 |
0.018 |
| 33 |
50 |
|
[IMD]C:505 |
3 |
1 |
198 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
17656 |
22.1 |
0.9 |
0.204 |
0 |
0 |
0 |
0.000 |
| 34 |
51 |
|
[GOL]B:502 |
1 |
1 |
222 |
f |
[BG6]B:501 |
x,y,z |
1_555 |
1 |
1 |
384 |
1.7 |
-0.1 |
0.395 |
0 |
0 |
0 |
0.002 |
| 35 |
52 |
|
[GOL]A:505 |
1 |
1 |
223 |
f |
[BG6]A:501 |
x,y,z |
1_555 |
1 |
1 |
381 |
0.3 |
-0.0 |
0.433 |
0 |
0 |
0 |
0.000 |
|