| ## |
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 |
263 |
75 |
12339 |
◊ |
A |
x,y,z |
1_555 |
210 |
51 |
16754 |
2413.1 |
-30.6 |
0.018 |
30 |
7 |
1 |
1.000 |
2 |
|
F |
270 |
75 |
12316 |
◊ |
E |
x,y,z |
1_555 |
218 |
51 |
16898 |
2399.2 |
-27.3 |
0.065 |
30 |
6 |
1 |
1.000 |
3 |
|
I |
276 |
77 |
12188 |
◊ |
H |
x,y,z |
1_555 |
214 |
51 |
16782 |
2381.5 |
-31.9 |
0.019 |
27 |
5 |
1 |
1.000 |
4 |
|
D |
258 |
74 |
12251 |
◊ |
C |
x,y,z |
1_555 |
215 |
51 |
16840 |
2379.6 |
-32.3 |
0.013 |
32 |
9 |
1 |
1.000 |
5 |
|
K |
271 |
76 |
12114 |
◊ |
J |
x,y,z |
1_555 |
216 |
51 |
16932 |
2371.1 |
-30.4 |
0.041 |
29 |
5 |
1 |
1.000 |
6 |
|
M |
251 |
71 |
12319 |
◊ |
L |
x,y,z |
1_555 |
202 |
48 |
16543 |
2277.7 |
-33.1 |
0.010 |
24 |
4 |
1 |
1.000 |
| Average: |
2370.4 |
-30.9 |
0.028 |
29 |
6 |
1 |
1.000 |
| 2 |
7 |
|
M |
137 |
32 |
12319 |
◊ |
K |
x,y,z |
1_555 |
132 |
38 |
12114 |
1285.3 |
-15.6 |
0.223 |
9 |
8 |
0 |
1.000 |
8 |
|
F |
128 |
39 |
12316 |
◊ |
B |
x,y,z |
1_555 |
126 |
33 |
12339 |
1283.6 |
-11.1 |
0.259 |
8 |
8 |
0 |
1.000 |
9 |
|
K |
131 |
32 |
12114 |
◊ |
I |
x,y,z |
1_555 |
125 |
38 |
12188 |
1270.2 |
-8.4 |
0.471 |
8 |
5 |
0 |
1.000 |
10 |
|
D |
132 |
35 |
12251 |
◊ |
B |
x,y,z |
1_555 |
124 |
40 |
12339 |
1267.5 |
-9.6 |
0.365 |
7 |
6 |
0 |
1.000 |
11 |
|
F |
132 |
32 |
12316 |
◊ |
D |
x,y,z |
1_555 |
126 |
36 |
12251 |
1266.7 |
-12.9 |
0.247 |
8 |
7 |
0 |
1.000 |
12 |
|
M |
125 |
36 |
12319 |
◊ |
I |
x,y,z |
1_555 |
124 |
30 |
12188 |
1246.7 |
-13.0 |
0.233 |
7 |
6 |
0 |
1.000 |
| Average: |
1270.0 |
-11.8 |
0.300 |
8 |
7 |
0 |
1.000 |
| 3 |
13 |
|
L |
46 |
14 |
16543 |
◊ |
J |
x,y,z |
1_555 |
53 |
16 |
16932 |
435.9 |
-2.1 |
0.389 |
7 |
0 |
0 |
0.043 |
14 |
|
J |
45 |
13 |
16932 |
◊ |
H |
x,y,z |
1_555 |
51 |
16 |
16782 |
426.6 |
0.8 |
0.727 |
9 |
0 |
0 |
0.043 |
15 |
|
L |
47 |
14 |
16543 |
◊ |
H |
x,y,z |
1_555 |
43 |
13 |
16782 |
422.3 |
3.1 |
0.867 |
8 |
0 |
0 |
0.043 |
16 |
|
E |
43 |
14 |
16898 |
◊ |
C |
x,y,z |
1_555 |
46 |
15 |
16840 |
419.4 |
1.9 |
0.796 |
7 |
0 |
0 |
0.043 |
17 |
|
E |
50 |
15 |
16898 |
◊ |
A |
x,y,z |
1_555 |
46 |
14 |
16754 |
411.8 |
1.3 |
0.766 |
10 |
0 |
0 |
0.043 |
18 |
|
C |
49 |
14 |
16840 |
◊ |
A |
x,y,z |
1_555 |
48 |
15 |
16754 |
397.2 |
2.1 |
0.811 |
8 |
0 |
0 |
0.043 |
| Average: |
418.9 |
1.2 |
0.726 |
8 |
0 |
0 |
0.043 |
| 4 |
19 |
|
F |
30 |
7 |
12316 |
◊ |
C |
x,y,z |
1_555 |
33 |
8 |
16840 |
296.1 |
-1.0 |
0.583 |
4 |
2 |
0 |
0.056 |
20 |
|
B |
31 |
8 |
12339 |
◊ |
E |
x,y,z |
1_555 |
27 |
8 |
16898 |
267.3 |
-1.5 |
0.515 |
4 |
2 |
0 |
0.056 |
21 |
|
I |
29 |
7 |
12188 |
◊ |
L |
x,y,z |
1_555 |
31 |
7 |
16543 |
265.1 |
-1.3 |
0.536 |
5 |
2 |
0 |
0.056 |
22 |
|
D |
29 |
6 |
12251 |
◊ |
A |
x,y,z |
1_555 |
26 |
7 |
16754 |
264.7 |
-1.7 |
0.489 |
4 |
2 |
0 |
0.056 |
23 |
|
K |
28 |
7 |
12114 |
◊ |
H |
x,y,z |
1_555 |
29 |
7 |
16782 |
261.7 |
-1.8 |
0.481 |
4 |
2 |
0 |
0.056 |
24 |
|
M |
29 |
6 |
12319 |
◊ |
J |
x,y,z |
1_555 |
27 |
8 |
16932 |
258.3 |
-1.9 |
0.448 |
4 |
2 |
0 |
0.056 |
| Average: |
268.9 |
-1.5 |
0.509 |
4 |
2 |
0 |
0.056 |
| 5 |
25 |
|
A |
40 |
15 |
16754 |
◊ |
E |
x-1,y,z |
1_455 |
32 |
10 |
16898 |
287.3 |
3.2 |
0.859 |
5 |
1 |
0 |
0.000 |
26 |
|
J |
36 |
12 |
16932 |
◊ |
H |
x-1,y,z |
1_455 |
28 |
8 |
16782 |
274.9 |
2.4 |
0.836 |
4 |
1 |
0 |
0.000 |
| Average: |
281.1 |
2.8 |
0.847 |
5 |
1 |
0 |
0.000 |
| 6 |
27 |
|
M |
37 |
13 |
12319 |
◊ |
H |
x,y,z |
1_555 |
27 |
6 |
16782 |
273.9 |
-4.7 |
0.131 |
2 |
0 |
0 |
0.083 |
28 |
|
K |
48 |
13 |
12114 |
◊ |
L |
x,y,z |
1_555 |
18 |
5 |
16543 |
270.2 |
-5.7 |
0.038 |
1 |
0 |
0 |
0.083 |
29 |
|
D |
42 |
13 |
12251 |
◊ |
E |
x,y,z |
1_555 |
20 |
4 |
16898 |
260.6 |
-4.3 |
0.114 |
1 |
0 |
0 |
0.083 |
30 |
|
F |
37 |
11 |
12316 |
◊ |
A |
x,y,z |
1_555 |
20 |
4 |
16754 |
252.8 |
-4.8 |
0.077 |
2 |
0 |
0 |
0.083 |
31 |
|
I |
35 |
12 |
12188 |
◊ |
J |
x,y,z |
1_555 |
22 |
5 |
16932 |
247.8 |
-4.8 |
0.076 |
2 |
0 |
0 |
0.083 |
32 |
|
B |
38 |
11 |
12339 |
◊ |
C |
x,y,z |
1_555 |
20 |
5 |
16840 |
232.4 |
-4.6 |
0.118 |
1 |
0 |
0 |
0.083 |
| Average: |
256.3 |
-4.8 |
0.092 |
2 |
0 |
0 |
0.083 |
| 7 |
33 |
|
L |
29 |
10 |
16543 |
◊ |
H |
x,y-1,z |
1_545 |
36 |
12 |
16782 |
270.9 |
4.3 |
0.924 |
4 |
1 |
0 |
0.000 |
| 8 |
34 |
|
A |
28 |
9 |
16754 |
◊ |
C |
x-1,y+1,z |
1_465 |
29 |
9 |
16840 |
246.9 |
2.8 |
0.850 |
5 |
2 |
0 |
0.000 |
| 9 |
35 |
|
C |
21 |
8 |
16840 |
◊ |
E |
x,y-1,z |
1_545 |
24 |
6 |
16898 |
211.6 |
0.5 |
0.641 |
1 |
0 |
0 |
0.000 |
36 |
|
J |
18 |
5 |
16932 |
◊ |
L |
x-1,y+1,z |
1_465 |
24 |
5 |
16543 |
192.9 |
0.2 |
0.618 |
3 |
0 |
0 |
0.000 |
| Average: |
202.3 |
0.4 |
0.629 |
2 |
0 |
0 |
0.000 |
| 10 |
37 |
|
K |
22 |
6 |
12114 |
◊ |
E |
x-1,y+1,z-1 |
1_464 |
23 |
7 |
16898 |
177.8 |
-0.9 |
0.573 |
2 |
0 |
0 |
0.000 |
| 11 |
38 |
|
J |
16 |
6 |
16932 |
◊ |
D |
x-1,y+1,z |
1_465 |
14 |
4 |
12251 |
142.0 |
1.4 |
0.805 |
3 |
1 |
0 |
0.000 |
| 12 |
39 |
|
[NAG]E:402 |
12 |
1 |
355 |
cf |
E |
x,y,z |
1_555 |
13 |
5 |
16898 |
133.4 |
4.1 |
0.382 |
1 |
0 |
0 |
0.000 |
40 |
|
[NAG]L:403 |
11 |
1 |
362 |
cf |
L |
x,y,z |
1_555 |
14 |
6 |
16543 |
123.7 |
3.3 |
0.353 |
0 |
0 |
0 |
0.000 |
| Average: |
128.6 |
3.7 |
0.368 |
1 |
0 |
0 |
0.000 |
| 13 |
41 |
|
[NAG]A:402 |
12 |
1 |
357 |
cf |
A |
x,y,z |
1_555 |
14 |
5 |
16754 |
124.4 |
3.5 |
0.336 |
1 |
0 |
0 |
0.000 |
42 |
|
[NAG]C:402 |
12 |
1 |
360 |
cf |
C |
x,y,z |
1_555 |
14 |
5 |
16840 |
121.0 |
2.5 |
0.282 |
1 |
0 |
0 |
0.000 |
| Average: |
122.7 |
3.0 |
0.309 |
1 |
0 |
0 |
0.000 |
| 14 |
43 |
|
[NAG]H:402 |
13 |
1 |
359 |
cf |
H |
x,y,z |
1_555 |
15 |
6 |
16782 |
123.6 |
3.6 |
0.327 |
1 |
0 |
0 |
0.000 |
| 15 |
44 |
|
[NAG]J:402 |
10 |
1 |
358 |
cf |
J |
x,y,z |
1_555 |
13 |
6 |
16932 |
111.9 |
3.4 |
0.408 |
1 |
0 |
0 |
0.000 |
| 16 |
45 |
|
[NAG]A:401 |
12 |
1 |
369 |
cf |
A |
x,y,z |
1_555 |
10 |
4 |
16754 |
103.4 |
3.2 |
0.332 |
0 |
0 |
0 |
0.000 |
| 17 |
46 |
|
[NAG]L:402 |
8 |
1 |
366 |
cf |
L |
x,y,z |
1_555 |
12 |
4 |
16543 |
98.7 |
2.1 |
0.360 |
1 |
0 |
0 |
0.000 |
| 18 |
47 |
|
B |
10 |
5 |
12339 |
◊ |
H |
x,y,z |
1_555 |
9 |
5 |
16782 |
95.6 |
-0.1 |
0.613 |
1 |
1 |
0 |
0.000 |
| 19 |
48 |
|
[NAG]E:401 |
9 |
1 |
363 |
cf |
E |
x,y,z |
1_555 |
9 |
5 |
16898 |
85.2 |
2.2 |
0.358 |
0 |
0 |
0 |
0.000 |
| 20 |
49 |
|
[NAG]J:401 |
7 |
1 |
366 |
cf |
J |
x,y,z |
1_555 |
9 |
2 |
16932 |
81.5 |
2.1 |
0.419 |
0 |
0 |
0 |
0.000 |
| 21 |
50 |
|
[NAG]H:401 |
7 |
1 |
368 |
cf |
H |
x,y,z |
1_555 |
9 |
4 |
16782 |
81.0 |
2.2 |
0.437 |
0 |
0 |
0 |
0.000 |
| 22 |
51 |
|
[NAG]C:401 |
9 |
1 |
362 |
cf |
C |
x,y,z |
1_555 |
7 |
3 |
16840 |
76.7 |
1.9 |
0.296 |
0 |
0 |
0 |
0.000 |
| 23 |
52 |
|
[NAG]A:403 |
8 |
1 |
360 |
cf |
[NAG]A:402 |
x,y,z |
1_555 |
6 |
1 |
357 |
73.8 |
1.9 |
0.098 |
0 |
0 |
0 |
0.000 |
| 24 |
53 |
|
[NAG]L:403 |
5 |
1 |
362 |
cf |
[NAG]L:401 |
x,y,z |
1_555 |
8 |
1 |
353 |
69.9 |
2.6 |
0.174 |
0 |
0 |
0 |
0.000 |
| 25 |
54 |
|
[NAG]E:403 |
9 |
1 |
354 |
cf |
[NAG]E:402 |
x,y,z |
1_555 |
8 |
1 |
355 |
66.7 |
2.1 |
0.072 |
0 |
0 |
0 |
0.000 |
| 26 |
55 |
|
[NAG]H:403 |
9 |
1 |
359 |
cf |
[NAG]H:402 |
x,y,z |
1_555 |
6 |
1 |
359 |
64.8 |
1.1 |
0.090 |
0 |
0 |
0 |
0.000 |
| 27 |
56 |
|
L |
5 |
3 |
16543 |
◊ |
F |
x-1,y,z |
1_455 |
6 |
3 |
12316 |
44.8 |
0.5 |
0.760 |
1 |
0 |
0 |
0.000 |
| 28 |
57 |
|
[NAG]J:402 |
1 |
1 |
358 |
◊ |
L |
x,y,z |
1_555 |
6 |
2 |
16543 |
37.2 |
1.0 |
0.562 |
0 |
0 |
0 |
0.000 |
| 29 |
58 |
|
[NAG]E:403 |
4 |
1 |
354 |
f |
E |
x,y,z |
1_555 |
3 |
1 |
16898 |
36.7 |
1.6 |
0.580 |
0 |
0 |
0 |
0.000 |
| 30 |
59 |
|
[NAG]H:402 |
2 |
1 |
359 |
◊ |
J |
x,y,z |
1_555 |
5 |
2 |
16932 |
35.7 |
1.1 |
0.541 |
0 |
0 |
0 |
0.000 |
| 31 |
60 |
|
[NAG]C:402 |
1 |
1 |
360 |
◊ |
E |
x,y,z |
1_555 |
6 |
2 |
16898 |
33.9 |
1.0 |
0.583 |
0 |
0 |
0 |
0.000 |
61 |
|
[NAG]A:402 |
1 |
1 |
357 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
16840 |
33.9 |
0.8 |
0.463 |
0 |
0 |
0 |
0.000 |
| Average: |
33.9 |
0.9 |
0.523 |
0 |
0 |
0 |
0.000 |
| 32 |
62 |
|
[NAG]L:403 |
1 |
1 |
362 |
◊ |
H |
x,y,z |
1_555 |
5 |
2 |
16782 |
32.7 |
1.0 |
0.607 |
0 |
0 |
0 |
0.000 |
| 33 |
63 |
|
[NAG]E:402 |
1 |
1 |
355 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
16754 |
30.9 |
0.7 |
0.449 |
0 |
0 |
0 |
0.000 |
| 34 |
64 |
|
[NAG]H:403 |
6 |
1 |
359 |
f |
H |
x,y,z |
1_555 |
3 |
1 |
16782 |
30.5 |
1.1 |
0.392 |
0 |
0 |
0 |
0.000 |
| 35 |
65 |
|
[NAG]L:401 |
4 |
1 |
353 |
f |
L |
x,y,z |
1_555 |
1 |
1 |
16543 |
21.5 |
0.9 |
0.467 |
0 |
0 |
0 |
0.000 |
| 36 |
66 |
|
[NAG]J:401 |
1 |
1 |
366 |
◊ |
I |
x,y,z |
1_555 |
2 |
1 |
12188 |
18.7 |
0.8 |
0.800 |
0 |
0 |
0 |
0.000 |
| 37 |
67 |
|
[NAG]L:401 |
5 |
1 |
353 |
◊ |
D |
x,y,z |
1_555 |
5 |
1 |
12251 |
17.3 |
-0.6 |
0.172 |
0 |
0 |
0 |
0.006 |
| 38 |
68 |
|
[NAG]A:403 |
6 |
1 |
360 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
16754 |
17.1 |
0.6 |
0.262 |
0 |
0 |
0 |
0.000 |
| 39 |
69 |
|
[NAG]L:403 |
1 |
1 |
362 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
12251 |
8.2 |
0.3 |
0.678 |
0 |
0 |
0 |
0.000 |
| 40 |
70 |
|
[NAG]A:403 |
1 |
1 |
360 |
◊ |
E |
x-1,y,z |
1_455 |
1 |
1 |
16898 |
7.7 |
-0.1 |
0.292 |
0 |
0 |
0 |
0.000 |
| 41 |
71 |
|
L |
2 |
2 |
16543 |
◊ |
E |
x-1,y,z |
1_455 |
1 |
1 |
16898 |
7.6 |
-0.0 |
0.418 |
0 |
0 |
0 |
0.000 |
| 42 |
72 |
|
C |
2 |
2 |
16840 |
◊ |
I |
x,y-1,z+1 |
1_546 |
1 |
1 |
12188 |
6.6 |
-0.2 |
0.357 |
0 |
0 |
0 |
0.000 |
| 43 |
73 |
|
[NAG]H:401 |
1 |
1 |
368 |
◊ |
M |
x,y,z |
1_555 |
1 |
1 |
12319 |
4.7 |
0.2 |
0.471 |
0 |
0 |
0 |
0.000 |
| 44 |
74 |
|
[NAG]A:402 |
2 |
1 |
357 |
◊ |
E |
x-1,y,z |
1_455 |
1 |
1 |
16898 |
3.4 |
-0.1 |
0.215 |
0 |
0 |
0 |
0.000 |
| 45 |
75 |
|
B |
1 |
1 |
12339 |
◊ |
L |
x,y,z |
1_555 |
2 |
1 |
16543 |
2.5 |
0.0 |
0.553 |
0 |
0 |
0 |
0.000 |
| 46 |
76 |
|
[NAG]A:401 |
1 |
1 |
369 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
12316 |
0.6 |
0.0 |
0.316 |
0 |
0 |
0 |
0.000 |
|