## |
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 |
|
F |
309 |
80 |
12681 |
◊ |
E |
x,y,z |
1_555 |
266 |
66 |
16170 |
2862.6 |
-35.6 |
0.049 |
41 |
4 |
1 |
1.000 |
2 |
|
B |
305 |
76 |
12783 |
◊ |
A |
x,y,z |
1_555 |
269 |
67 |
16816 |
2847.0 |
-34.7 |
0.060 |
41 |
4 |
1 |
1.000 |
3 |
|
D |
305 |
80 |
12645 |
◊ |
C |
x,y,z |
1_555 |
258 |
66 |
15922 |
2832.2 |
-34.8 |
0.050 |
43 |
4 |
1 |
1.000 |
Average: |
2847.3 |
-35.0 |
0.053 |
42 |
4 |
1 |
1.000 |
2 |
4 |
|
F |
125 |
37 |
12681 |
◊ |
B |
x,y,z |
1_555 |
145 |
36 |
12783 |
1410.2 |
-10.5 |
0.403 |
21 |
24 |
0 |
1.000 |
5 |
|
D |
143 |
35 |
12645 |
◊ |
B |
x,y,z |
1_555 |
128 |
36 |
12783 |
1389.0 |
-10.9 |
0.385 |
21 |
25 |
0 |
1.000 |
6 |
|
F |
142 |
34 |
12681 |
◊ |
D |
x,y,z |
1_555 |
126 |
36 |
12645 |
1386.2 |
-10.7 |
0.381 |
21 |
24 |
0 |
1.000 |
Average: |
1395.1 |
-10.7 |
0.390 |
21 |
24 |
0 |
1.000 |
3 |
7 |
|
E |
59 |
17 |
16170 |
◊ |
A |
x,y,z |
1_555 |
57 |
17 |
16816 |
514.1 |
-0.2 |
0.713 |
8 |
0 |
0 |
1.000 |
8 |
|
E |
50 |
16 |
16170 |
◊ |
C |
x,y,z |
1_555 |
58 |
14 |
15922 |
455.1 |
0.2 |
0.758 |
10 |
0 |
0 |
1.000 |
9 |
|
C |
48 |
15 |
15922 |
◊ |
A |
x,y,z |
1_555 |
51 |
14 |
16816 |
427.5 |
-1.3 |
0.618 |
6 |
0 |
0 |
1.000 |
Average: |
465.6 |
-0.4 |
0.696 |
8 |
0 |
0 |
1.000 |
4 |
10 |
|
E |
41 |
16 |
16170 |
◊ |
E |
-x,y,-z |
2_555 |
41 |
16 |
16170 |
419.5 |
2.9 |
0.905 |
2 |
2 |
0 |
0.000 |
5 |
11 |
|
E |
44 |
12 |
16170 |
◊ |
A |
x,y,z-1 |
1_554 |
37 |
11 |
16816 |
348.1 |
-1.3 |
0.597 |
2 |
0 |
0 |
0.000 |
6 |
12 |
|
A |
38 |
11 |
16816 |
◊ |
A |
-x,y,-z+1 |
2_556 |
38 |
11 |
16816 |
345.4 |
3.1 |
0.903 |
4 |
4 |
0 |
0.000 |
7 |
13 |
|
C |
39 |
13 |
15922 |
◊ |
D |
-x-1/2,y-1/2,-z |
4_445 |
30 |
12 |
12645 |
322.9 |
-0.4 |
0.677 |
3 |
0 |
0 |
0.000 |
8 |
14 |
|
F |
34 |
9 |
12681 |
◊ |
C |
x,y,z |
1_555 |
34 |
14 |
15922 |
295.8 |
-1.5 |
0.566 |
4 |
3 |
0 |
0.054 |
15 |
|
B |
33 |
10 |
12783 |
◊ |
E |
x,y,z |
1_555 |
31 |
13 |
16170 |
280.4 |
-2.2 |
0.503 |
3 |
2 |
0 |
0.054 |
16 |
|
D |
31 |
9 |
12645 |
◊ |
A |
x,y,z |
1_555 |
32 |
13 |
16816 |
279.8 |
-1.6 |
0.559 |
3 |
0 |
0 |
0.054 |
Average: |
285.3 |
-1.8 |
0.543 |
3 |
2 |
0 |
0.054 |
9 |
17 |
|
D |
37 |
12 |
12645 |
◊ |
E |
x,y,z |
1_555 |
31 |
7 |
16170 |
282.4 |
-0.2 |
0.709 |
2 |
1 |
0 |
0.019 |
18 |
|
B |
39 |
14 |
12783 |
◊ |
C |
x,y,z |
1_555 |
28 |
7 |
15922 |
272.8 |
-0.6 |
0.649 |
2 |
0 |
0 |
0.019 |
19 |
|
F |
39 |
13 |
12681 |
◊ |
A |
x,y,z |
1_555 |
27 |
7 |
16816 |
264.0 |
-0.5 |
0.633 |
1 |
0 |
0 |
0.019 |
Average: |
273.1 |
-0.4 |
0.664 |
2 |
0 |
0 |
0.019 |
10 |
20 |
|
C |
18 |
6 |
15922 |
◊ |
E |
-x-1/2,y-1/2,-z |
4_445 |
17 |
6 |
16170 |
149.5 |
-1.4 |
0.387 |
1 |
0 |
0 |
0.000 |
11 |
21 |
|
[NAG]A:404 |
12 |
1 |
365 |
cf |
A |
x,y,z |
1_555 |
16 |
6 |
16816 |
137.0 |
4.2 |
0.425 |
1 |
0 |
0 |
0.000 |
22 |
|
[NAG]C:502 |
12 |
1 |
366 |
cf |
C |
x,y,z |
1_555 |
16 |
6 |
15922 |
130.5 |
4.3 |
0.447 |
0 |
0 |
0 |
0.000 |
Average: |
133.7 |
4.3 |
0.436 |
1 |
0 |
0 |
0.000 |
12 |
23 |
|
F |
20 |
6 |
12681 |
◊ |
A |
-x,y,-z+1 |
2_556 |
12 |
3 |
16816 |
132.5 |
-0.6 |
0.594 |
0 |
0 |
0 |
0.053 |
13 |
24 |
|
[NAG]E:507 |
10 |
1 |
361 |
cf |
E |
x,y,z |
1_555 |
15 |
8 |
16170 |
121.5 |
4.2 |
0.550 |
1 |
0 |
0 |
0.000 |
25 |
|
[NAG]A:408 |
10 |
1 |
364 |
cf |
A |
x,y,z |
1_555 |
14 |
7 |
16816 |
120.7 |
4.2 |
0.526 |
0 |
0 |
0 |
0.000 |
26 |
|
[NAG]C:506 |
10 |
1 |
364 |
cf |
C |
x,y,z |
1_555 |
15 |
8 |
15922 |
119.9 |
4.2 |
0.543 |
1 |
0 |
0 |
0.000 |
Average: |
120.7 |
4.2 |
0.540 |
1 |
0 |
0 |
0.000 |
14 |
27 |
|
[NAG]C:503 |
10 |
1 |
360 |
cf |
C |
x,y,z |
1_555 |
12 |
5 |
15922 |
101.8 |
3.0 |
0.408 |
0 |
0 |
0 |
0.000 |
28 |
|
[NAG]A:405 |
10 |
1 |
364 |
cf |
A |
x,y,z |
1_555 |
13 |
4 |
16816 |
98.7 |
2.4 |
0.354 |
0 |
0 |
0 |
0.000 |
29 |
|
[NAG]E:502 |
10 |
1 |
362 |
cf |
E |
x,y,z |
1_555 |
11 |
4 |
16170 |
97.9 |
2.4 |
0.339 |
0 |
0 |
0 |
0.000 |
Average: |
99.5 |
2.6 |
0.367 |
0 |
0 |
0 |
0.000 |
15 |
30 |
|
[NAG]C:503 |
9 |
1 |
360 |
◊ |
E |
x,y,z |
1_555 |
12 |
6 |
16170 |
99.4 |
1.0 |
0.239 |
1 |
0 |
0 |
0.000 |
16 |
31 |
|
[NAG]C:501 |
9 |
1 |
365 |
cf |
C |
x,y,z |
1_555 |
13 |
6 |
15922 |
98.9 |
2.8 |
0.465 |
0 |
0 |
0 |
0.000 |
17 |
32 |
|
[NAG]C:504 |
10 |
1 |
362 |
◊ |
E |
x,y,z |
1_555 |
15 |
3 |
16170 |
96.3 |
0.4 |
0.166 |
1 |
0 |
0 |
0.000 |
33 |
|
[NAG]A:406 |
10 |
1 |
363 |
◊ |
C |
x,y,z |
1_555 |
16 |
4 |
15922 |
93.0 |
1.0 |
0.202 |
1 |
0 |
0 |
0.000 |
Average: |
94.7 |
0.7 |
0.184 |
1 |
0 |
0 |
0.000 |
18 |
34 |
|
[NAG]E:501 |
9 |
1 |
361 |
cf |
E |
x,y,z |
1_555 |
12 |
5 |
16170 |
92.9 |
2.0 |
0.336 |
1 |
0 |
0 |
0.000 |
19 |
35 |
|
[NAG]A:401 |
8 |
1 |
363 |
cf |
A |
x,y,z |
1_555 |
10 |
5 |
16816 |
88.3 |
2.4 |
0.412 |
1 |
0 |
0 |
0.000 |
20 |
36 |
|
[NAG]E:502 |
7 |
1 |
362 |
◊ |
A |
x,y,z |
1_555 |
11 |
7 |
16816 |
88.3 |
1.5 |
0.353 |
1 |
0 |
0 |
0.000 |
37 |
|
[NAG]A:405 |
8 |
1 |
364 |
◊ |
C |
x,y,z |
1_555 |
11 |
7 |
15922 |
78.0 |
1.3 |
0.313 |
1 |
0 |
0 |
0.000 |
Average: |
83.1 |
1.4 |
0.333 |
1 |
0 |
0 |
0.000 |
21 |
38 |
|
[NAG]E:503 |
11 |
1 |
364 |
◊ |
A |
x,y,z |
1_555 |
13 |
4 |
16816 |
87.7 |
0.9 |
0.173 |
1 |
0 |
0 |
0.000 |
22 |
39 |
|
[NAG]A:406 |
8 |
1 |
363 |
cf |
[NAG]A:405 |
x,y,z |
1_555 |
7 |
1 |
364 |
77.9 |
1.7 |
0.105 |
1 |
0 |
0 |
0.000 |
40 |
|
[NAG]C:504 |
10 |
1 |
362 |
cf |
[NAG]C:503 |
x,y,z |
1_555 |
7 |
1 |
360 |
77.1 |
2.0 |
0.091 |
1 |
0 |
0 |
0.000 |
41 |
|
[NAG]E:503 |
9 |
1 |
364 |
cf |
[NAG]E:502 |
x,y,z |
1_555 |
7 |
1 |
362 |
73.5 |
1.6 |
0.084 |
0 |
0 |
0 |
0.000 |
42 |
|
[NAG]A:402 |
10 |
1 |
363 |
cf |
[NAG]A:401 |
x,y,z |
1_555 |
6 |
1 |
363 |
73.1 |
1.5 |
0.079 |
0 |
0 |
0 |
0.000 |
Average: |
75.4 |
1.7 |
0.090 |
1 |
0 |
0 |
0.000 |
23 |
43 |
|
B |
7 |
4 |
12783 |
◊ |
A |
-x,y,-z+1 |
2_556 |
9 |
3 |
16816 |
77.5 |
-0.5 |
0.531 |
0 |
0 |
0 |
0.046 |
24 |
44 |
|
[NAG]E:508 |
9 |
1 |
361 |
cf |
[NAG]E:507 |
x,y,z |
1_555 |
7 |
1 |
361 |
77.0 |
2.0 |
0.125 |
0 |
0 |
0 |
0.000 |
25 |
45 |
|
[NAG]A:409 |
8 |
1 |
363 |
cf |
[NAG]A:408 |
x,y,z |
1_555 |
6 |
1 |
364 |
75.2 |
2.4 |
0.161 |
0 |
0 |
0 |
0.000 |
46 |
|
[NAG]C:507 |
9 |
1 |
365 |
cf |
[NAG]C:506 |
x,y,z |
1_555 |
6 |
1 |
364 |
73.8 |
1.7 |
0.101 |
0 |
0 |
0 |
0.000 |
Average: |
74.5 |
2.0 |
0.131 |
0 |
0 |
0 |
0.000 |
26 |
47 |
|
[BMA]A:403 |
7 |
1 |
293 |
cf |
[NAG]A:402 |
x,y,z |
1_555 |
6 |
1 |
363 |
61.8 |
1.1 |
0.108 |
0 |
0 |
0 |
0.000 |
27 |
48 |
|
[BMA]E:504 |
7 |
1 |
291 |
cf |
[NAG]E:503 |
x,y,z |
1_555 |
6 |
1 |
364 |
61.4 |
1.2 |
0.096 |
1 |
0 |
0 |
0.000 |
28 |
49 |
|
[BMA]C:505 |
6 |
1 |
294 |
cf |
[NAG]C:504 |
x,y,z |
1_555 |
5 |
1 |
362 |
61.1 |
1.1 |
0.135 |
0 |
0 |
0 |
0.000 |
29 |
50 |
|
[BMA]A:407 |
7 |
1 |
293 |
cf |
[NAG]A:406 |
x,y,z |
1_555 |
5 |
1 |
363 |
60.2 |
1.1 |
0.110 |
0 |
0 |
0 |
0.000 |
30 |
51 |
|
[MAN]E:505 |
7 |
1 |
292 |
cf |
[BMA]E:504 |
x,y,z |
1_555 |
5 |
1 |
291 |
60.0 |
2.7 |
0.231 |
0 |
0 |
0 |
0.000 |
31 |
52 |
|
[BMA]E:504 |
7 |
1 |
291 |
◊ |
A |
x,y,z |
1_555 |
10 |
1 |
16816 |
59.9 |
0.9 |
0.246 |
0 |
0 |
0 |
0.000 |
32 |
53 |
|
[BMA]A:407 |
7 |
1 |
293 |
◊ |
C |
x,y,z |
1_555 |
10 |
1 |
15922 |
55.5 |
1.1 |
0.312 |
0 |
0 |
0 |
0.000 |
33 |
54 |
|
[NAG]E:503 |
4 |
1 |
364 |
f |
E |
x,y,z |
1_555 |
8 |
4 |
16170 |
53.8 |
1.5 |
0.454 |
0 |
0 |
0 |
0.000 |
34 |
55 |
|
[MAN]E:506 |
4 |
1 |
292 |
cf |
[BMA]E:504 |
x,y,z |
1_555 |
4 |
1 |
291 |
52.3 |
2.4 |
0.321 |
0 |
0 |
0 |
0.000 |
35 |
56 |
|
[NAG]A:406 |
3 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
16816 |
51.2 |
1.4 |
0.508 |
0 |
0 |
0 |
0.000 |
57 |
|
[NAG]C:504 |
3 |
1 |
362 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
15922 |
45.3 |
1.5 |
0.577 |
0 |
0 |
0 |
0.000 |
Average: |
48.2 |
1.5 |
0.543 |
0 |
0 |
0 |
0.000 |
36 |
58 |
|
C |
4 |
2 |
15922 |
x |
C |
-x-1/2,y-1/2,-z |
4_445 |
7 |
2 |
15922 |
50.1 |
-0.3 |
0.486 |
0 |
0 |
0 |
0.000 |
37 |
59 |
|
[MAN]E:506 |
6 |
1 |
292 |
f |
[NAG]E:503 |
x,y,z |
1_555 |
5 |
1 |
364 |
48.6 |
1.7 |
0.185 |
0 |
0 |
0 |
0.000 |
38 |
60 |
|
[MAN]E:506 |
5 |
1 |
292 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
16816 |
43.0 |
0.8 |
0.365 |
0 |
0 |
0 |
0.000 |
39 |
61 |
|
[MAN]E:506 |
3 |
1 |
292 |
f |
E |
x,y,z |
1_555 |
4 |
2 |
16170 |
38.4 |
1.6 |
0.538 |
2 |
0 |
0 |
0.000 |
40 |
62 |
|
[BMA]C:505 |
6 |
1 |
294 |
◊ |
E |
x,y,z |
1_555 |
7 |
1 |
16170 |
36.7 |
0.9 |
0.348 |
0 |
0 |
0 |
0.000 |
41 |
63 |
|
[NAG]E:501 |
2 |
1 |
361 |
◊ |
F |
x,y,z |
1_555 |
2 |
2 |
12681 |
31.1 |
0.4 |
0.367 |
0 |
0 |
0 |
0.000 |
42 |
64 |
|
[NAG]A:409 |
1 |
1 |
363 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
12783 |
29.2 |
1.0 |
0.761 |
0 |
0 |
0 |
0.000 |
43 |
65 |
|
[NAG]E:508 |
1 |
1 |
361 |
◊ |
F |
x,y,z |
1_555 |
3 |
1 |
12681 |
28.2 |
1.0 |
0.733 |
0 |
0 |
0 |
0.000 |
44 |
66 |
|
[NAG]C:507 |
1 |
1 |
365 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
12645 |
26.5 |
1.0 |
0.736 |
0 |
0 |
0 |
0.000 |
45 |
67 |
|
[MAN]E:505 |
4 |
1 |
292 |
f |
[NAG]E:503 |
x,y,z |
1_555 |
3 |
1 |
364 |
23.4 |
0.7 |
0.181 |
0 |
0 |
0 |
0.000 |
46 |
68 |
|
C |
2 |
2 |
15922 |
x |
C |
-x-1/2,y-1/2,-z+1 |
4_446 |
3 |
1 |
15922 |
22.4 |
0.3 |
0.511 |
0 |
0 |
0 |
0.000 |
47 |
69 |
|
[NAG]A:409 |
2 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
2 |
2 |
16816 |
20.4 |
1.3 |
0.595 |
0 |
0 |
0 |
0.000 |
70 |
|
[NAG]C:507 |
2 |
1 |
365 |
f |
C |
x,y,z |
1_555 |
2 |
2 |
15922 |
16.5 |
1.1 |
0.591 |
0 |
0 |
0 |
0.000 |
Average: |
18.5 |
1.2 |
0.593 |
0 |
0 |
0 |
0.000 |
48 |
71 |
|
[NAG]E:507 |
1 |
1 |
361 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
12681 |
15.8 |
0.7 |
0.823 |
0 |
0 |
0 |
0.000 |
72 |
|
[NAG]A:408 |
1 |
1 |
364 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
12783 |
15.3 |
0.7 |
0.823 |
0 |
0 |
0 |
0.000 |
73 |
|
[NAG]C:506 |
1 |
1 |
364 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
12645 |
14.0 |
0.6 |
0.785 |
0 |
0 |
0 |
0.000 |
Average: |
15.0 |
0.7 |
0.810 |
0 |
0 |
0 |
0.000 |
49 |
74 |
|
[NAG]E:508 |
2 |
1 |
361 |
f |
E |
x,y,z |
1_555 |
1 |
1 |
16170 |
15.8 |
1.0 |
0.555 |
0 |
0 |
0 |
0.000 |
50 |
75 |
|
C |
2 |
2 |
15922 |
◊ |
[NAG]C:501 |
-x-1/2,y-1/2,-z |
4_445 |
2 |
1 |
365 |
9.6 |
0.0 |
0.287 |
0 |
0 |
0 |
0.000 |
51 |
76 |
|
[MAN]E:505 |
1 |
1 |
292 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
16816 |
9.5 |
0.2 |
0.451 |
0 |
0 |
0 |
0.000 |
52 |
77 |
|
[NAG]A:402 |
1 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
16816 |
0.2 |
0.0 |
0.294 |
0 |
0 |
0 |
0.000 |
|