| ## |
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 |
150 |
37 |
10824 |
◊ |
D |
-y,x-y,z |
2_555 |
154 |
38 |
10872 |
1468.8 |
-11.7 |
0.572 |
32 |
7 |
0 |
1.000 |
2 |
|
C |
150 |
37 |
10849 |
◊ |
B |
-y,x-y,z |
2_555 |
156 |
36 |
10856 |
1426.8 |
-12.5 |
0.569 |
28 |
7 |
0 |
1.000 |
| Average: |
1447.8 |
-12.1 |
0.570 |
30 |
7 |
0 |
1.000 |
| 2 |
3 |
|
H |
87 |
23 |
8451 |
◊ |
G |
x,y,z |
1_555 |
85 |
26 |
8292 |
812.2 |
-14.0 |
0.023 |
11 |
1 |
1 |
1.000 |
4 |
|
F |
88 |
24 |
8491 |
◊ |
E |
x,y,z |
1_555 |
85 |
21 |
8499 |
806.1 |
-13.2 |
0.026 |
12 |
0 |
1 |
1.000 |
| Average: |
809.1 |
-13.6 |
0.025 |
12 |
1 |
1 |
1.000 |
| 3 |
5 |
|
C |
59 |
20 |
10849 |
◊ |
B |
x,y,z |
1_555 |
62 |
20 |
10856 |
600.8 |
-1.7 |
0.757 |
11 |
7 |
0 |
0.268 |
6 |
|
D |
61 |
21 |
10872 |
◊ |
A |
x,y,z |
1_555 |
62 |
20 |
10824 |
599.4 |
-0.7 |
0.814 |
10 |
7 |
0 |
0.268 |
| Average: |
600.1 |
-1.2 |
0.785 |
11 |
7 |
0 |
0.268 |
| 4 |
7 |
|
D |
68 |
16 |
10872 |
◊ |
C |
x,y,z |
1_555 |
67 |
16 |
10849 |
593.8 |
1.8 |
0.920 |
8 |
3 |
0 |
0.000 |
| 5 |
8 |
|
E |
47 |
13 |
8499 |
◊ |
A |
x,y,z |
1_555 |
44 |
12 |
10824 |
442.6 |
-0.1 |
0.668 |
9 |
2 |
0 |
0.170 |
9 |
|
G |
49 |
12 |
8292 |
◊ |
B |
x,y,z |
1_555 |
42 |
12 |
10856 |
442.3 |
-0.7 |
0.646 |
9 |
3 |
0 |
0.170 |
10 |
|
H |
48 |
12 |
8451 |
◊ |
C |
x,y,z |
1_555 |
41 |
11 |
10849 |
427.4 |
-1.3 |
0.609 |
10 |
3 |
0 |
0.170 |
| Average: |
437.5 |
-0.7 |
0.641 |
9 |
3 |
0 |
0.170 |
| 6 |
11 |
|
G |
47 |
15 |
8292 |
◊ |
E |
x,y,z-1 |
1_554 |
45 |
15 |
8499 |
406.4 |
-0.6 |
0.601 |
2 |
2 |
0 |
0.000 |
| 7 |
12 |
|
F |
43 |
11 |
8491 |
◊ |
D |
x,y,z |
1_555 |
42 |
11 |
10872 |
402.8 |
-3.0 |
0.425 |
7 |
0 |
0 |
0.094 |
| 8 |
13 |
|
G |
32 |
8 |
8292 |
◊ |
F |
-y-1/3,x-y-2/3,z-2/3 |
5_444 |
44 |
13 |
8491 |
314.0 |
-0.6 |
0.588 |
4 |
0 |
0 |
0.000 |
| 9 |
14 |
|
B |
33 |
11 |
10856 |
◊ |
E |
x,y,z-1 |
1_554 |
30 |
7 |
8499 |
261.2 |
-2.7 |
0.423 |
3 |
0 |
0 |
0.000 |
15 |
|
G |
23 |
6 |
8292 |
◊ |
A |
x,y,z-1 |
1_554 |
27 |
8 |
10824 |
226.0 |
-3.6 |
0.256 |
3 |
1 |
0 |
0.000 |
| Average: |
243.6 |
-3.2 |
0.340 |
3 |
1 |
0 |
0.000 |
| 10 |
16 |
|
B |
29 |
8 |
10856 |
x |
B |
-y,x-y,z |
2_555 |
20 |
5 |
10856 |
252.6 |
-4.0 |
0.282 |
1 |
0 |
0 |
0.158 |
17 |
|
A |
20 |
5 |
10824 |
x |
A |
-y,x-y,z |
2_555 |
27 |
8 |
10824 |
243.4 |
-3.1 |
0.372 |
1 |
0 |
0 |
0.158 |
| Average: |
248.0 |
-3.6 |
0.327 |
1 |
0 |
0 |
0.158 |
| 11 |
18 |
|
D |
29 |
8 |
10872 |
x |
D |
-y,x-y,z |
2_555 |
20 |
5 |
10872 |
245.7 |
-3.4 |
0.332 |
1 |
0 |
0 |
0.145 |
19 |
|
C |
19 |
5 |
10849 |
x |
C |
-y,x-y,z |
2_555 |
30 |
8 |
10849 |
241.1 |
-3.3 |
0.359 |
1 |
0 |
0 |
0.145 |
| Average: |
243.4 |
-3.4 |
0.346 |
1 |
0 |
0 |
0.145 |
| 12 |
20 |
|
H |
28 |
6 |
8451 |
◊ |
B |
x,y,z |
1_555 |
26 |
9 |
10856 |
223.6 |
-0.1 |
0.646 |
5 |
0 |
0 |
0.072 |
21 |
|
F |
28 |
6 |
8491 |
◊ |
A |
x,y,z |
1_555 |
25 |
9 |
10824 |
212.7 |
-0.8 |
0.544 |
3 |
0 |
0 |
0.072 |
22 |
|
E |
26 |
6 |
8499 |
◊ |
D |
x,y,z |
1_555 |
24 |
9 |
10872 |
208.3 |
-0.3 |
0.616 |
5 |
0 |
0 |
0.072 |
23 |
|
G |
26 |
6 |
8292 |
◊ |
C |
x,y,z |
1_555 |
24 |
9 |
10849 |
202.3 |
0.1 |
0.680 |
4 |
0 |
0 |
0.072 |
| Average: |
211.7 |
-0.3 |
0.621 |
4 |
0 |
0 |
0.072 |
| 13 |
24 |
|
B |
26 |
8 |
10856 |
◊ |
A |
x,y,z-1 |
1_554 |
24 |
7 |
10824 |
215.9 |
0.0 |
0.759 |
2 |
0 |
0 |
0.000 |
| 14 |
25 |
|
[NAG]D:300 |
13 |
1 |
364 |
cf |
D |
x,y,z |
1_555 |
27 |
11 |
10872 |
177.1 |
3.3 |
0.386 |
2 |
0 |
0 |
0.000 |
26 |
|
[NAG]C:300 |
13 |
1 |
355 |
cf |
C |
x,y,z |
1_555 |
26 |
10 |
10849 |
171.5 |
3.0 |
0.368 |
1 |
0 |
0 |
0.000 |
| Average: |
174.3 |
3.2 |
0.377 |
2 |
0 |
0 |
0.000 |
| 15 |
27 |
|
[NAG]B:300 |
14 |
1 |
364 |
cf |
B |
x,y,z |
1_555 |
23 |
9 |
10856 |
169.8 |
3.0 |
0.308 |
1 |
0 |
0 |
0.000 |
28 |
|
[NAG]A:300 |
13 |
1 |
357 |
cf |
A |
x,y,z |
1_555 |
25 |
9 |
10824 |
167.8 |
2.9 |
0.374 |
2 |
0 |
0 |
0.000 |
| Average: |
168.8 |
2.9 |
0.341 |
2 |
0 |
0 |
0.000 |
| 16 |
29 |
|
[NAG]D:301 |
10 |
1 |
361 |
f |
D |
x,y,z |
1_555 |
17 |
5 |
10872 |
106.3 |
2.1 |
0.367 |
1 |
0 |
0 |
0.000 |
| 17 |
30 |
|
[NAG]A:301 |
11 |
1 |
355 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
10824 |
106.1 |
1.2 |
0.232 |
0 |
0 |
0 |
0.000 |
| 18 |
31 |
|
[NAG]B:301 |
11 |
1 |
363 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
10856 |
103.4 |
1.5 |
0.234 |
1 |
0 |
0 |
0.000 |
32 |
|
[NAG]C:301 |
10 |
1 |
357 |
f |
C |
x,y,z |
1_555 |
15 |
4 |
10849 |
102.7 |
2.0 |
0.316 |
1 |
0 |
0 |
0.000 |
| Average: |
103.1 |
1.7 |
0.275 |
1 |
0 |
0 |
0.000 |
| 19 |
33 |
|
B |
10 |
6 |
10856 |
◊ |
E |
-y-1/3,x-y-2/3,z-2/3 |
5_444 |
16 |
4 |
8499 |
91.8 |
-1.6 |
0.355 |
0 |
0 |
0 |
0.000 |
| 20 |
34 |
|
F |
9 |
4 |
8491 |
◊ |
G |
-y-1/3,x-y-2/3,z+1/3 |
5_445 |
14 |
7 |
8292 |
80.1 |
0.5 |
0.705 |
1 |
0 |
0 |
0.000 |
| 21 |
35 |
|
[NAG]D:301 |
10 |
1 |
361 |
cf |
[NAG]D:300 |
x,y,z |
1_555 |
7 |
1 |
364 |
72.0 |
1.8 |
0.086 |
0 |
0 |
0 |
0.000 |
36 |
|
[NAG]A:301 |
9 |
1 |
355 |
cf |
[NAG]A:300 |
x,y,z |
1_555 |
6 |
1 |
357 |
71.6 |
1.8 |
0.101 |
1 |
0 |
0 |
0.000 |
| Average: |
71.8 |
1.8 |
0.093 |
1 |
0 |
0 |
0.000 |
| 22 |
37 |
|
D |
7 |
3 |
10872 |
◊ |
H |
-y-1/3,x-y-2/3,z+1/3 |
5_445 |
8 |
2 |
8451 |
71.6 |
-1.8 |
0.206 |
0 |
0 |
0 |
0.000 |
| 23 |
38 |
|
[NAG]B:301 |
9 |
1 |
363 |
cf |
[NAG]B:300 |
x,y,z |
1_555 |
6 |
1 |
364 |
71.2 |
1.5 |
0.083 |
1 |
0 |
0 |
0.000 |
39 |
|
[NAG]C:301 |
9 |
1 |
357 |
cf |
[NAG]C:300 |
x,y,z |
1_555 |
6 |
1 |
355 |
68.0 |
1.6 |
0.087 |
0 |
0 |
0 |
0.000 |
| Average: |
69.6 |
1.5 |
0.085 |
1 |
0 |
0 |
0.000 |
| 24 |
40 |
|
[BMA]D:302 |
7 |
1 |
291 |
cf |
[NAG]D:301 |
x,y,z |
1_555 |
5 |
1 |
361 |
61.5 |
1.4 |
0.135 |
0 |
0 |
0 |
0.000 |
| 25 |
41 |
|
[BMA]C:302 |
6 |
1 |
290 |
cf |
[NAG]C:301 |
x,y,z |
1_555 |
5 |
1 |
357 |
60.8 |
1.5 |
0.150 |
0 |
0 |
0 |
0.000 |
42 |
|
[BMA]B:302 |
6 |
1 |
290 |
cf |
[NAG]B:301 |
x,y,z |
1_555 |
4 |
1 |
363 |
59.4 |
1.6 |
0.199 |
0 |
0 |
0 |
0.000 |
| Average: |
60.1 |
1.6 |
0.175 |
0 |
0 |
0 |
0.000 |
| 26 |
43 |
|
[BMA]A:302 |
6 |
1 |
290 |
cf |
[NAG]A:301 |
x,y,z |
1_555 |
5 |
1 |
355 |
59.5 |
1.8 |
0.170 |
0 |
0 |
0 |
0.000 |
| 27 |
44 |
|
A |
8 |
6 |
10824 |
◊ |
H |
-x+y+2/3,-x+1/3,z+1/3 |
6_555 |
8 |
3 |
8451 |
45.6 |
0.6 |
0.758 |
0 |
0 |
0 |
0.000 |
| 28 |
45 |
|
F |
5 |
2 |
8491 |
◊ |
C |
x,y,z |
1_555 |
9 |
2 |
10849 |
37.9 |
0.5 |
0.755 |
0 |
0 |
0 |
0.000 |
46 |
|
H |
6 |
2 |
8451 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
10872 |
30.9 |
0.6 |
0.670 |
0 |
0 |
0 |
0.000 |
| Average: |
34.4 |
0.6 |
0.712 |
0 |
0 |
0 |
0.000 |
| 29 |
47 |
|
C |
5 |
2 |
10849 |
◊ |
E |
-x+y+2/3,-x+1/3,z-2/3 |
6_554 |
4 |
1 |
8499 |
31.8 |
0.1 |
0.412 |
0 |
0 |
0 |
0.000 |
| 30 |
48 |
|
C |
2 |
1 |
10849 |
◊ |
G |
-x+y+2/3,-x+1/3,z+1/3 |
6_555 |
5 |
2 |
8292 |
18.7 |
-0.5 |
0.355 |
0 |
0 |
0 |
0.000 |
| 31 |
49 |
|
[BMA]A:302 |
2 |
1 |
290 |
f |
A |
x,y,z |
1_555 |
3 |
2 |
10824 |
7.9 |
0.2 |
0.410 |
0 |
0 |
0 |
0.000 |
50 |
|
[BMA]B:302 |
2 |
1 |
290 |
f |
B |
x,y,z |
1_555 |
2 |
2 |
10856 |
2.8 |
0.1 |
0.402 |
0 |
0 |
0 |
0.000 |
| Average: |
5.4 |
0.1 |
0.406 |
0 |
0 |
0 |
0.000 |
| 32 |
51 |
|
H |
3 |
1 |
8451 |
◊ |
E |
x,y,z-1 |
1_554 |
1 |
1 |
8499 |
7.2 |
0.3 |
0.762 |
0 |
0 |
0 |
0.000 |
| 33 |
52 |
|
[BMA]D:302 |
2 |
1 |
291 |
f |
D |
x,y,z |
1_555 |
1 |
1 |
10872 |
2.4 |
-0.0 |
0.350 |
0 |
0 |
0 |
0.000 |
|