## |
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 |
|
L |
205 |
55 |
11625 |
◊ |
H |
x,y,z |
1_555 |
210 |
57 |
12292 |
1953.3 |
-20.1 |
0.201 |
15 |
6 |
0 |
1.000 |
2 |
|
D |
187 |
56 |
11746 |
◊ |
B |
x,y,z |
1_555 |
204 |
59 |
12038 |
1804.3 |
-23.2 |
0.071 |
14 |
5 |
0 |
1.000 |
Average: |
1878.8 |
-21.7 |
0.136 |
15 |
6 |
0 |
1.000 |
2 |
3 |
|
I |
173 |
51 |
11528 |
◊ |
G |
x,y,z |
1_555 |
184 |
52 |
11680 |
1664.2 |
-28.0 |
0.032 |
14 |
0 |
0 |
1.000 |
4 |
|
F |
160 |
47 |
11448 |
◊ |
E |
x,y,z |
1_555 |
174 |
51 |
11407 |
1597.1 |
-23.9 |
0.100 |
16 |
2 |
0 |
1.000 |
Average: |
1630.6 |
-26.0 |
0.066 |
15 |
1 |
0 |
1.000 |
3 |
5 |
|
H |
98 |
26 |
12292 |
◊ |
C |
x,y,z |
1_555 |
111 |
23 |
9904 |
979.5 |
-6.7 |
0.621 |
13 |
3 |
0 |
1.000 |
6 |
|
B |
99 |
28 |
12038 |
◊ |
A |
x,y,z |
1_555 |
110 |
23 |
9517 |
955.9 |
-9.4 |
0.420 |
16 |
3 |
0 |
1.000 |
Average: |
967.7 |
-8.1 |
0.521 |
15 |
3 |
0 |
1.000 |
4 |
7 |
|
E |
75 |
28 |
11407 |
◊ |
D |
x-1/2,-y+3/2,-z |
4_465 |
84 |
27 |
11746 |
712.3 |
-3.6 |
0.623 |
9 |
0 |
0 |
0.000 |
5 |
8 |
|
F |
73 |
15 |
11448 |
◊ |
C |
x,y,z |
1_555 |
72 |
24 |
9904 |
623.7 |
-10.1 |
0.191 |
4 |
0 |
0 |
0.553 |
6 |
9 |
|
I |
74 |
16 |
11528 |
◊ |
A |
x,y,z |
1_555 |
69 |
24 |
9517 |
615.0 |
-7.7 |
0.336 |
11 |
0 |
0 |
0.367 |
7 |
10 |
|
L |
59 |
23 |
11625 |
◊ |
I |
-x,y-1/2,-z-1/2 |
3_544 |
55 |
16 |
11528 |
514.0 |
-1.7 |
0.545 |
8 |
0 |
0 |
0.000 |
8 |
11 |
|
B |
49 |
17 |
12038 |
◊ |
C |
x,y,z |
1_555 |
52 |
16 |
9904 |
465.8 |
-5.1 |
0.421 |
5 |
0 |
0 |
0.000 |
12 |
|
H |
40 |
15 |
12292 |
◊ |
A |
x-1,y,z |
1_455 |
47 |
14 |
9517 |
412.7 |
-5.1 |
0.350 |
4 |
0 |
0 |
0.000 |
Average: |
439.2 |
-5.1 |
0.385 |
5 |
0 |
0 |
0.000 |
9 |
13 |
|
F |
47 |
19 |
11448 |
◊ |
H |
x-1/2,-y+1/2,-z |
4_455 |
46 |
12 |
12292 |
438.6 |
-0.2 |
0.748 |
5 |
0 |
0 |
0.000 |
10 |
14 |
|
I |
47 |
15 |
11528 |
◊ |
E |
-x-1/2,-y+1,z-1/2 |
2_464 |
46 |
13 |
11407 |
366.9 |
-1.6 |
0.707 |
5 |
0 |
0 |
0.000 |
15 |
|
G |
38 |
12 |
11680 |
◊ |
F |
-x-1/2,-y+1,z-1/2 |
2_464 |
29 |
9 |
11448 |
259.3 |
-3.2 |
0.439 |
0 |
0 |
0 |
0.000 |
Average: |
313.1 |
-2.4 |
0.573 |
3 |
0 |
0 |
0.000 |
11 |
16 |
|
I |
37 |
13 |
11528 |
◊ |
F |
-x-1/2,-y+1,z-1/2 |
2_464 |
35 |
13 |
11448 |
320.0 |
-3.0 |
0.481 |
2 |
0 |
0 |
0.000 |
12 |
17 |
|
G |
41 |
15 |
11680 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
35 |
14 |
11407 |
291.8 |
-3.2 |
0.503 |
1 |
0 |
0 |
0.000 |
13 |
18 |
|
I |
31 |
12 |
11528 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
29 |
8 |
11448 |
270.2 |
-0.2 |
0.689 |
3 |
0 |
0 |
0.000 |
14 |
19 |
|
G |
28 |
11 |
11680 |
◊ |
B |
-x+1,y-1/2,-z-1/2 |
3_644 |
28 |
8 |
12038 |
230.5 |
-0.4 |
0.704 |
2 |
0 |
0 |
0.000 |
15 |
20 |
|
[NAG]A:5408 |
12 |
1 |
360 |
cf |
A |
x,y,z |
1_555 |
17 |
7 |
9517 |
156.8 |
3.9 |
0.476 |
2 |
0 |
0 |
0.000 |
16 |
21 |
|
[NAG]C:4312 |
12 |
1 |
360 |
cf |
C |
x,y,z |
1_555 |
24 |
8 |
9904 |
156.7 |
3.7 |
0.425 |
2 |
0 |
0 |
0.000 |
17 |
22 |
|
F |
20 |
9 |
11448 |
◊ |
L |
x-1/2,-y+1/2,-z |
4_455 |
11 |
6 |
11625 |
147.1 |
-1.1 |
0.495 |
0 |
0 |
0 |
0.000 |
18 |
23 |
|
E |
15 |
6 |
11407 |
◊ |
C |
x,y,z |
1_555 |
17 |
6 |
9904 |
146.5 |
0.1 |
0.750 |
2 |
2 |
0 |
0.020 |
19 |
24 |
|
[NAG]A:5402 |
13 |
1 |
355 |
cf |
A |
x,y,z |
1_555 |
18 |
9 |
9517 |
144.6 |
3.4 |
0.375 |
0 |
0 |
0 |
0.000 |
20 |
25 |
|
[NAG]C:4305 |
13 |
1 |
357 |
cf |
C |
x,y,z |
1_555 |
18 |
6 |
9904 |
142.6 |
3.3 |
0.352 |
3 |
0 |
0 |
0.000 |
21 |
26 |
|
G |
15 |
5 |
11680 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
20 |
5 |
9904 |
141.6 |
-0.1 |
0.713 |
1 |
0 |
0 |
0.000 |
22 |
27 |
|
I |
16 |
3 |
11528 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
14 |
5 |
11407 |
114.6 |
-0.6 |
0.627 |
0 |
0 |
0 |
0.000 |
23 |
28 |
|
[NAG]C:4302 |
11 |
1 |
360 |
cf |
C |
x,y,z |
1_555 |
11 |
5 |
9904 |
114.1 |
2.2 |
0.324 |
1 |
0 |
0 |
0.000 |
24 |
29 |
|
D |
16 |
5 |
11746 |
x |
D |
x-1/2,-y+3/2,-z |
4_465 |
13 |
7 |
11746 |
113.2 |
-1.7 |
0.317 |
0 |
0 |
0 |
0.000 |
25 |
30 |
|
[NAG]C:4310 |
9 |
1 |
352 |
cf |
C |
x,y,z |
1_555 |
14 |
3 |
9904 |
107.6 |
2.3 |
0.370 |
1 |
0 |
0 |
0.000 |
26 |
31 |
|
[NAG]C:4301 |
8 |
1 |
361 |
cf |
C |
x,y,z |
1_555 |
8 |
4 |
9904 |
90.1 |
1.7 |
0.347 |
2 |
0 |
0 |
0.000 |
27 |
32 |
|
[NAG]A:5406 |
7 |
1 |
355 |
cf |
A |
x,y,z |
1_555 |
6 |
3 |
9517 |
86.4 |
2.1 |
0.422 |
0 |
0 |
0 |
0.000 |
28 |
33 |
|
[NAG]A:5401 |
10 |
1 |
358 |
cf |
A |
x,y,z |
1_555 |
9 |
4 |
9517 |
86.1 |
1.9 |
0.330 |
0 |
0 |
0 |
0.000 |
29 |
34 |
|
G |
11 |
5 |
11680 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
9517 |
84.4 |
0.7 |
0.751 |
1 |
2 |
0 |
0.000 |
30 |
35 |
|
[NAG]C:4306 |
8 |
1 |
352 |
cf |
[NAG]C:4305 |
x,y,z |
1_555 |
8 |
1 |
357 |
80.8 |
2.0 |
0.104 |
1 |
0 |
0 |
0.000 |
31 |
36 |
|
L |
9 |
2 |
11625 |
◊ |
G |
-x,y-1/2,-z-1/2 |
3_544 |
10 |
2 |
11680 |
77.2 |
0.9 |
0.806 |
1 |
0 |
0 |
0.000 |
32 |
37 |
|
[NAG]A:5409 |
10 |
1 |
363 |
cf |
[NAG]A:5408 |
x,y,z |
1_555 |
6 |
1 |
360 |
75.9 |
1.8 |
0.087 |
1 |
0 |
0 |
0.000 |
33 |
38 |
|
[NAG]C:4311 |
10 |
1 |
361 |
cf |
[NAG]C:4310 |
x,y,z |
1_555 |
8 |
1 |
352 |
73.7 |
2.1 |
0.066 |
0 |
0 |
0 |
0.000 |
34 |
39 |
|
[NAG]C:4303 |
9 |
1 |
363 |
cf |
[NAG]C:4302 |
x,y,z |
1_555 |
6 |
1 |
360 |
73.7 |
2.0 |
0.115 |
0 |
0 |
0 |
0.000 |
35 |
40 |
|
[NAG]A:5407 |
8 |
1 |
362 |
cf |
[NAG]A:5406 |
x,y,z |
1_555 |
6 |
1 |
355 |
72.7 |
2.0 |
0.115 |
0 |
0 |
0 |
0.000 |
36 |
41 |
|
[NAG]A:5403 |
9 |
1 |
350 |
cf |
[NAG]A:5402 |
x,y,z |
1_555 |
6 |
1 |
355 |
71.6 |
1.4 |
0.091 |
1 |
0 |
0 |
0.000 |
37 |
42 |
|
[NAG]C:4313 |
9 |
1 |
359 |
cf |
[NAG]C:4312 |
x,y,z |
1_555 |
6 |
1 |
360 |
70.8 |
1.9 |
0.096 |
0 |
0 |
0 |
0.000 |
38 |
43 |
|
[BMA]A:5404 |
5 |
1 |
294 |
cf |
[NAG]A:5403 |
x,y,z |
1_555 |
5 |
1 |
350 |
65.2 |
1.7 |
0.171 |
0 |
0 |
0 |
0.000 |
39 |
44 |
|
[NAG]C:4302 |
5 |
1 |
360 |
◊ |
F |
x,y,z |
1_555 |
10 |
3 |
11448 |
64.9 |
1.3 |
0.407 |
1 |
0 |
0 |
0.000 |
40 |
45 |
|
[BMA]C:4307 |
5 |
1 |
289 |
cf |
[NAG]C:4306 |
x,y,z |
1_555 |
6 |
1 |
352 |
61.9 |
1.1 |
0.146 |
0 |
0 |
0 |
0.000 |
41 |
46 |
|
[MAN]C:4308 |
6 |
1 |
291 |
cf |
[BMA]C:4307 |
x,y,z |
1_555 |
6 |
1 |
289 |
61.2 |
3.0 |
0.253 |
0 |
0 |
0 |
0.000 |
42 |
47 |
|
[BMA]C:4314 |
6 |
1 |
292 |
cf |
[NAG]C:4313 |
x,y,z |
1_555 |
4 |
1 |
359 |
59.4 |
1.1 |
0.107 |
0 |
0 |
0 |
0.000 |
43 |
48 |
|
[MAN]C:4309 |
7 |
1 |
294 |
cf |
[BMA]C:4307 |
x,y,z |
1_555 |
6 |
1 |
289 |
59.4 |
2.7 |
0.182 |
0 |
0 |
0 |
0.000 |
44 |
49 |
|
C |
4 |
1 |
9904 |
◊ |
D |
x-1/2,-y+3/2,-z |
4_465 |
3 |
2 |
11746 |
58.9 |
-0.5 |
0.386 |
1 |
0 |
0 |
0.000 |
45 |
50 |
|
[MAN]A:5405 |
6 |
1 |
296 |
cf |
[BMA]A:5404 |
x,y,z |
1_555 |
5 |
1 |
294 |
58.1 |
2.5 |
0.257 |
0 |
0 |
0 |
0.000 |
46 |
51 |
|
[BMA]C:4304 |
7 |
1 |
296 |
cf |
[NAG]C:4303 |
x,y,z |
1_555 |
5 |
1 |
363 |
57.9 |
1.4 |
0.115 |
0 |
0 |
0 |
0.000 |
47 |
52 |
|
[NAG]C:4313 |
6 |
1 |
359 |
f |
C |
x,y,z |
1_555 |
9 |
4 |
9904 |
56.6 |
0.5 |
0.248 |
0 |
0 |
0 |
0.000 |
48 |
53 |
|
[NAG]C:4301 |
8 |
1 |
361 |
◊ |
L |
x,y,z |
1_555 |
7 |
3 |
11625 |
56.1 |
1.4 |
0.289 |
0 |
0 |
0 |
0.000 |
49 |
54 |
|
[BMA]A:5410 |
7 |
1 |
299 |
cf |
[NAG]A:5409 |
x,y,z |
1_555 |
5 |
1 |
363 |
56.0 |
1.2 |
0.104 |
0 |
0 |
0 |
0.000 |
50 |
55 |
|
[NAG]A:5401 |
3 |
1 |
358 |
◊ |
I |
x,y,z |
1_555 |
8 |
4 |
11528 |
51.0 |
1.3 |
0.512 |
0 |
0 |
0 |
0.000 |
51 |
56 |
|
[NAG]A:5406 |
7 |
1 |
355 |
◊ |
D |
x,y,z |
1_555 |
6 |
3 |
11746 |
48.0 |
1.8 |
0.380 |
0 |
0 |
0 |
0.000 |
52 |
57 |
|
[NAG]A:5406 |
5 |
1 |
355 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
12038 |
47.0 |
0.8 |
0.278 |
0 |
0 |
0 |
0.000 |
53 |
58 |
|
[NAG]A:5403 |
5 |
1 |
350 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
9517 |
45.4 |
-0.0 |
0.283 |
0 |
0 |
0 |
0.000 |
54 |
59 |
|
G |
5 |
4 |
11680 |
◊ |
D |
-x+1/2,-y+1,z-1/2 |
2_564 |
5 |
1 |
11746 |
44.3 |
-0.9 |
0.330 |
0 |
0 |
0 |
0.000 |
55 |
60 |
|
[NAG]C:4301 |
4 |
1 |
361 |
◊ |
H |
x,y,z |
1_555 |
7 |
1 |
12292 |
42.6 |
0.7 |
0.381 |
0 |
0 |
0 |
0.000 |
56 |
61 |
|
[NAG]A:5409 |
3 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
4 |
1 |
9517 |
36.2 |
0.2 |
0.302 |
0 |
0 |
0 |
0.000 |
57 |
62 |
|
[NAG]A:5407 |
4 |
1 |
362 |
◊ |
D |
x,y,z |
1_555 |
4 |
1 |
11746 |
35.2 |
0.4 |
0.262 |
0 |
0 |
0 |
0.000 |
58 |
63 |
|
[MAN]A:5405 |
3 |
1 |
296 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
9517 |
31.8 |
0.2 |
0.397 |
1 |
0 |
0 |
0.011 |
59 |
64 |
|
[NAG]A:5407 |
3 |
1 |
362 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
9517 |
31.0 |
0.6 |
0.454 |
0 |
0 |
0 |
0.000 |
60 |
65 |
|
[MAN]C:4309 |
2 |
1 |
294 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
2 |
12038 |
25.2 |
0.9 |
0.502 |
0 |
0 |
0 |
0.000 |
61 |
66 |
|
[MAN]A:5405 |
4 |
1 |
296 |
f |
[NAG]A:5403 |
x,y,z |
1_555 |
3 |
1 |
350 |
23.7 |
0.7 |
0.161 |
1 |
0 |
0 |
0.000 |
62 |
67 |
|
[BMA]C:4314 |
3 |
1 |
292 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
11746 |
23.4 |
0.5 |
0.438 |
0 |
0 |
0 |
0.000 |
63 |
68 |
|
L |
2 |
1 |
11625 |
◊ |
[MAN]A:5405 |
x-1,y,z |
1_455 |
4 |
1 |
296 |
23.1 |
0.7 |
0.340 |
1 |
0 |
0 |
0.000 |
64 |
69 |
|
[MAN]C:4309 |
5 |
1 |
294 |
f |
[NAG]C:4306 |
x,y,z |
1_555 |
2 |
1 |
352 |
21.6 |
0.4 |
0.146 |
1 |
0 |
0 |
0.000 |
65 |
70 |
|
G |
3 |
1 |
11680 |
◊ |
E |
-x-1/2,-y+1,z-1/2 |
2_464 |
1 |
1 |
11407 |
19.4 |
0.4 |
0.833 |
0 |
0 |
0 |
0.000 |
66 |
71 |
|
[NAG]C:4303 |
1 |
1 |
363 |
f |
C |
x,y,z |
1_555 |
3 |
3 |
9904 |
16.5 |
0.4 |
0.616 |
0 |
0 |
0 |
0.000 |
67 |
72 |
|
[BMA]C:4314 |
2 |
1 |
292 |
◊ |
H |
x,y,z |
1_555 |
2 |
2 |
12292 |
16.4 |
0.4 |
0.436 |
0 |
0 |
0 |
0.000 |
68 |
73 |
|
[NAG]C:4306 |
3 |
1 |
352 |
f |
C |
x,y,z |
1_555 |
5 |
3 |
9904 |
15.4 |
0.3 |
0.384 |
0 |
0 |
0 |
0.000 |
69 |
74 |
|
L |
3 |
2 |
11625 |
◊ |
C |
x,y,z |
1_555 |
5 |
2 |
9904 |
12.6 |
0.2 |
0.713 |
0 |
0 |
0 |
0.000 |
75 |
|
D |
2 |
2 |
11746 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
9517 |
8.3 |
0.0 |
0.657 |
0 |
0 |
0 |
0.000 |
Average: |
10.5 |
0.1 |
0.685 |
0 |
0 |
0 |
0.000 |
70 |
76 |
|
[BMA]A:5404 |
3 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
9517 |
12.4 |
0.2 |
0.333 |
0 |
0 |
0 |
0.000 |
71 |
77 |
|
[BMA]A:5410 |
1 |
1 |
299 |
◊ |
H |
x,y,z |
1_555 |
1 |
1 |
12292 |
10.8 |
0.2 |
0.389 |
0 |
0 |
0 |
0.000 |
72 |
78 |
|
[MAN]C:4308 |
3 |
1 |
291 |
f |
[NAG]C:4306 |
x,y,z |
1_555 |
1 |
1 |
352 |
10.8 |
0.5 |
0.300 |
0 |
0 |
0 |
0.000 |
73 |
79 |
|
[MAN]C:4308 |
3 |
1 |
291 |
◊ |
B |
x-1,y,z |
1_455 |
1 |
1 |
12038 |
10.6 |
0.0 |
0.245 |
0 |
0 |
0 |
0.000 |
74 |
80 |
|
A |
2 |
1 |
9517 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
2 |
1 |
11407 |
9.6 |
-0.1 |
0.518 |
0 |
0 |
0 |
0.000 |
75 |
81 |
|
L |
1 |
1 |
11625 |
◊ |
A |
x-1,y,z |
1_455 |
1 |
1 |
9517 |
5.1 |
-0.0 |
0.497 |
0 |
0 |
0 |
0.000 |
76 |
82 |
|
[NAG]C:4313 |
1 |
1 |
359 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
11746 |
1.8 |
-0.0 |
0.317 |
0 |
0 |
0 |
0.000 |
77 |
83 |
|
[BMA]A:5404 |
1 |
1 |
294 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
12038 |
1.8 |
0.0 |
0.362 |
0 |
0 |
0 |
0.000 |
78 |
84 |
|
E |
1 |
1 |
11407 |
◊ |
D |
x-1,y,z |
1_455 |
1 |
1 |
11746 |
1.7 |
0.1 |
0.736 |
0 |
0 |
0 |
0.000 |
79 |
85 |
|
L |
1 |
1 |
11625 |
◊ |
[BMA]A:5404 |
x-1,y,z |
1_455 |
1 |
1 |
294 |
0.4 |
0.0 |
0.342 |
0 |
0 |
0 |
0.000 |
|