| ## |
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 |
|
C |
174 |
45 |
12421 |
◊ |
A |
x,y,z |
1_555 |
179 |
45 |
12692 |
1813.8 |
-32.0 |
0.022 |
10 |
0 |
0 |
0.432 |
2 |
|
D |
173 |
45 |
12302 |
◊ |
B |
x,y,z |
1_555 |
171 |
45 |
12338 |
1791.2 |
-33.6 |
0.010 |
10 |
0 |
0 |
0.432 |
| Average: |
1802.5 |
-32.8 |
0.016 |
10 |
0 |
0 |
0.432 |
| 2 |
3 |
|
D |
152 |
39 |
12302 |
◊ |
C |
x,y,z |
1_555 |
156 |
39 |
12421 |
1355.9 |
-23.3 |
0.106 |
11 |
0 |
0 |
0.359 |
4 |
|
B |
151 |
39 |
12338 |
◊ |
A |
x,y,z |
1_555 |
150 |
39 |
12692 |
1337.4 |
-22.5 |
0.103 |
9 |
0 |
0 |
0.359 |
| Average: |
1346.7 |
-22.9 |
0.104 |
10 |
0 |
0 |
0.359 |
| 3 |
5 |
|
[NAP]C:1269 |
44 |
1 |
889 |
f |
C |
x,y,z |
1_555 |
86 |
33 |
12421 |
555.5 |
-0.9 |
0.756 |
16 |
0 |
0 |
0.218 |
6 |
|
[NAP]A:1269 |
46 |
1 |
880 |
f |
A |
x,y,z |
1_555 |
88 |
34 |
12692 |
554.7 |
-1.0 |
0.742 |
16 |
0 |
0 |
0.218 |
7 |
|
[NAP]D:1269 |
45 |
1 |
884 |
f |
D |
x,y,z |
1_555 |
84 |
31 |
12302 |
554.5 |
-0.9 |
0.745 |
16 |
0 |
0 |
0.218 |
8 |
|
[NAP]B:1269 |
44 |
1 |
877 |
f |
B |
x,y,z |
1_555 |
87 |
32 |
12338 |
548.4 |
-0.6 |
0.754 |
18 |
0 |
0 |
0.218 |
| Average: |
553.3 |
-0.8 |
0.749 |
17 |
0 |
0 |
0.218 |
| 4 |
9 |
|
D |
63 |
16 |
12302 |
◊ |
A |
x,y,z |
1_555 |
65 |
16 |
12692 |
530.6 |
-6.3 |
0.457 |
4 |
0 |
0 |
0.065 |
10 |
|
C |
62 |
14 |
12421 |
◊ |
B |
x,y,z |
1_555 |
58 |
15 |
12338 |
525.6 |
-6.5 |
0.401 |
3 |
0 |
0 |
0.065 |
| Average: |
528.1 |
-6.4 |
0.429 |
4 |
0 |
0 |
0.065 |
| 5 |
11 |
|
B |
49 |
14 |
12338 |
◊ |
C |
x-1,y,z-1 |
1_454 |
51 |
17 |
12421 |
415.1 |
-3.0 |
0.629 |
4 |
0 |
0 |
0.030 |
| 6 |
12 |
|
A |
47 |
17 |
12692 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
45 |
15 |
12338 |
412.2 |
-0.4 |
0.806 |
6 |
6 |
0 |
0.000 |
| 7 |
13 |
|
D |
33 |
14 |
12302 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
32 |
14 |
12421 |
285.1 |
-0.2 |
0.773 |
3 |
0 |
0 |
0.000 |
| 8 |
14 |
|
[W8G]B:1271 |
16 |
1 |
392 |
f |
B |
x,y,z |
1_555 |
41 |
16 |
12338 |
243.8 |
-4.9 |
0.433 |
3 |
0 |
0 |
0.162 |
15 |
|
[W8G]A:1271 |
16 |
1 |
389 |
f |
A |
x,y,z |
1_555 |
42 |
15 |
12692 |
238.3 |
-4.8 |
0.460 |
3 |
0 |
0 |
0.162 |
16 |
|
[W8G]C:1271 |
16 |
1 |
388 |
f |
C |
x,y,z |
1_555 |
38 |
15 |
12421 |
236.6 |
-4.7 |
0.417 |
3 |
0 |
0 |
0.162 |
17 |
|
[W8G]D:1271 |
16 |
1 |
387 |
f |
D |
x,y,z |
1_555 |
38 |
15 |
12302 |
233.3 |
-4.6 |
0.429 |
3 |
0 |
0 |
0.162 |
| Average: |
238.0 |
-4.8 |
0.435 |
3 |
0 |
0 |
0.162 |
| 9 |
18 |
|
D |
24 |
7 |
12302 |
◊ |
A |
x-1,y,z |
1_455 |
24 |
7 |
12692 |
236.9 |
-3.0 |
0.401 |
2 |
0 |
0 |
0.000 |
| 10 |
19 |
|
[W8G]D:1270 |
16 |
1 |
392 |
f |
D |
x,y,z |
1_555 |
28 |
11 |
12302 |
197.1 |
-3.5 |
0.449 |
3 |
0 |
0 |
0.062 |
| 11 |
20 |
|
[W8G]C:1270 |
16 |
1 |
390 |
f |
C |
x,y,z |
1_555 |
28 |
11 |
12421 |
196.4 |
-3.5 |
0.458 |
2 |
0 |
0 |
0.094 |
21 |
|
[W8G]A:1270 |
16 |
1 |
388 |
f |
A |
x,y,z |
1_555 |
29 |
11 |
12692 |
193.1 |
-2.4 |
0.651 |
3 |
0 |
0 |
0.094 |
| Average: |
194.7 |
-2.9 |
0.554 |
3 |
0 |
0 |
0.094 |
| 12 |
22 |
|
[W8G]B:1270 |
16 |
1 |
395 |
f |
B |
x,y,z |
1_555 |
29 |
10 |
12338 |
190.2 |
-3.1 |
0.563 |
3 |
0 |
0 |
0.058 |
| 13 |
23 |
|
[W8G]B:1270 |
14 |
1 |
395 |
f |
[NAP]B:1269 |
x,y,z |
1_555 |
18 |
1 |
877 |
121.5 |
-3.3 |
0.380 |
2 |
0 |
0 |
0.055 |
| 14 |
24 |
|
[W8G]C:1270 |
15 |
1 |
390 |
f |
[NAP]C:1269 |
x,y,z |
1_555 |
18 |
1 |
889 |
116.4 |
-2.7 |
0.444 |
2 |
0 |
0 |
0.082 |
25 |
|
[W8G]A:1270 |
14 |
1 |
388 |
f |
[NAP]A:1269 |
x,y,z |
1_555 |
18 |
1 |
880 |
115.9 |
-2.7 |
0.418 |
2 |
0 |
0 |
0.082 |
| Average: |
116.2 |
-2.7 |
0.431 |
2 |
0 |
0 |
0.082 |
| 15 |
26 |
|
[W8G]D:1270 |
14 |
1 |
392 |
f |
[NAP]D:1269 |
x,y,z |
1_555 |
18 |
1 |
884 |
116.3 |
-2.6 |
0.438 |
2 |
0 |
0 |
0.044 |
| 16 |
27 |
|
B |
11 |
3 |
12338 |
◊ |
D |
x,y,z-1 |
1_554 |
6 |
3 |
12302 |
84.0 |
0.5 |
0.791 |
2 |
0 |
0 |
0.000 |
| 17 |
28 |
|
[ACT]C:1272 |
4 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
13 |
7 |
12421 |
80.4 |
-1.2 |
0.568 |
1 |
0 |
0 |
0.020 |
| 18 |
29 |
|
[ACT]A:1272 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
12692 |
74.4 |
-0.6 |
0.671 |
1 |
0 |
0 |
0.014 |
| 19 |
30 |
|
[ACT]A:1272 |
4 |
1 |
182 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
13 |
7 |
12338 |
73.9 |
-0.5 |
0.706 |
1 |
0 |
0 |
0.000 |
| 20 |
31 |
|
B |
8 |
6 |
12338 |
◊ |
[ACT]C:1272 |
x-1,y,z-1 |
1_454 |
4 |
1 |
183 |
71.5 |
-0.7 |
0.564 |
1 |
0 |
0 |
0.007 |
| 21 |
32 |
|
[W8G]D:1271 |
13 |
1 |
387 |
f |
[W8G]D:1270 |
x,y,z |
1_555 |
6 |
1 |
392 |
67.1 |
-1.8 |
0.552 |
0 |
0 |
0 |
0.023 |
33 |
|
[W8G]A:1271 |
13 |
1 |
389 |
f |
[W8G]A:1270 |
x,y,z |
1_555 |
5 |
1 |
388 |
65.6 |
-1.6 |
0.557 |
0 |
0 |
0 |
0.023 |
| Average: |
66.4 |
-1.7 |
0.554 |
0 |
0 |
0 |
0.023 |
| 22 |
34 |
|
[W8G]C:1271 |
13 |
1 |
388 |
f |
[W8G]C:1270 |
x,y,z |
1_555 |
6 |
1 |
390 |
65.6 |
-1.7 |
0.553 |
0 |
0 |
0 |
0.022 |
| 23 |
35 |
|
[W8G]B:1271 |
13 |
1 |
392 |
f |
[W8G]B:1270 |
x,y,z |
1_555 |
5 |
1 |
395 |
58.9 |
-1.5 |
0.585 |
0 |
0 |
0 |
0.020 |
| 24 |
36 |
|
[W8G]A:1271 |
6 |
1 |
389 |
f |
[NAP]A:1269 |
x,y,z |
1_555 |
5 |
1 |
880 |
49.2 |
-0.4 |
0.554 |
0 |
0 |
0 |
0.011 |
37 |
|
[W8G]B:1271 |
6 |
1 |
392 |
f |
[NAP]B:1269 |
x,y,z |
1_555 |
5 |
1 |
877 |
47.5 |
-0.4 |
0.569 |
0 |
0 |
0 |
0.011 |
38 |
|
[W8G]C:1271 |
6 |
1 |
388 |
f |
[NAP]C:1269 |
x,y,z |
1_555 |
5 |
1 |
889 |
47.5 |
-0.4 |
0.568 |
0 |
0 |
0 |
0.011 |
39 |
|
[W8G]D:1271 |
6 |
1 |
387 |
f |
[NAP]D:1269 |
x,y,z |
1_555 |
5 |
1 |
884 |
47.4 |
-0.4 |
0.569 |
0 |
0 |
0 |
0.011 |
| Average: |
47.9 |
-0.4 |
0.565 |
0 |
0 |
0 |
0.011 |
| 25 |
40 |
|
A |
2 |
2 |
12692 |
◊ |
C |
x,y,z-1 |
1_554 |
5 |
3 |
12421 |
31.7 |
-0.2 |
0.543 |
0 |
0 |
0 |
0.000 |
| 26 |
41 |
|
C |
3 |
1 |
12421 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
4 |
1 |
12302 |
30.9 |
-0.7 |
0.320 |
0 |
0 |
0 |
0.000 |
| 27 |
42 |
|
B |
5 |
2 |
12338 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
2 |
1 |
12692 |
14.5 |
-0.1 |
0.632 |
0 |
0 |
0 |
0.000 |
| 28 |
43 |
|
D |
1 |
1 |
12302 |
◊ |
C |
x-1,y,z |
1_455 |
1 |
1 |
12421 |
7.4 |
-0.0 |
0.481 |
0 |
0 |
0 |
0.000 |
44 |
|
B |
1 |
1 |
12338 |
◊ |
A |
x-1,y,z |
1_455 |
1 |
1 |
12692 |
0.9 |
0.0 |
0.631 |
0 |
0 |
0 |
0.000 |
| Average: |
4.2 |
-0.0 |
0.556 |
0 |
0 |
0 |
0.000 |
|