## |
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 |
|
D |
54 |
19 |
7670 |
◊ |
B |
x,y,z |
1_555 |
60 |
17 |
7706 |
553.5 |
3.7 |
0.856 |
8 |
2 |
0 |
0.000 |
2 |
|
B |
52 |
19 |
7706 |
◊ |
D |
x,y,z-1 |
1_554 |
54 |
16 |
7670 |
532.8 |
3.5 |
0.855 |
9 |
2 |
0 |
0.000 |
Average: |
543.2 |
3.6 |
0.855 |
9 |
2 |
0 |
0.000 |
2 |
3 |
|
B |
50 |
21 |
7706 |
◊ |
C |
x-1,y,z |
1_455 |
53 |
21 |
7682 |
444.8 |
-3.1 |
0.269 |
6 |
0 |
0 |
0.000 |
4 |
|
A |
45 |
17 |
7650 |
◊ |
D |
x,y,z-1 |
1_554 |
46 |
20 |
7670 |
348.5 |
-3.8 |
0.185 |
4 |
0 |
0 |
0.000 |
Average: |
396.7 |
-3.5 |
0.227 |
5 |
0 |
0 |
0.000 |
3 |
5 |
|
B |
32 |
10 |
7706 |
◊ |
C |
x-1,y,z-1 |
1_454 |
37 |
15 |
7682 |
311.2 |
0.9 |
0.597 |
5 |
0 |
0 |
0.000 |
6 |
|
D |
29 |
11 |
7670 |
◊ |
A |
x,y,z |
1_555 |
37 |
15 |
7650 |
276.0 |
0.0 |
0.432 |
5 |
0 |
0 |
0.000 |
Average: |
293.6 |
0.5 |
0.515 |
5 |
0 |
0 |
0.000 |
4 |
7 |
|
B |
30 |
10 |
7706 |
x |
B |
x-1,y,z |
1_455 |
32 |
11 |
7706 |
305.3 |
-1.7 |
0.273 |
0 |
2 |
0 |
0.000 |
8 |
|
D |
29 |
11 |
7670 |
x |
D |
x-1,y,z |
1_455 |
32 |
11 |
7670 |
291.9 |
-1.0 |
0.380 |
1 |
1 |
0 |
0.000 |
9 |
|
C |
30 |
11 |
7682 |
x |
C |
x-1,y,z |
1_455 |
33 |
10 |
7682 |
284.3 |
-0.5 |
0.454 |
3 |
1 |
0 |
0.000 |
10 |
|
A |
32 |
10 |
7650 |
x |
A |
x-1,y,z |
1_455 |
31 |
12 |
7650 |
277.0 |
-0.7 |
0.418 |
1 |
1 |
0 |
0.000 |
Average: |
289.6 |
-1.0 |
0.381 |
1 |
1 |
0 |
0.000 |
5 |
11 |
|
C |
31 |
11 |
7682 |
◊ |
A |
-x+3,y-1/2,-z+1 |
2_846 |
31 |
10 |
7650 |
295.4 |
0.8 |
0.663 |
4 |
0 |
0 |
0.000 |
6 |
12 |
|
B |
39 |
12 |
7706 |
◊ |
A |
-x+2,y-1/2,-z+1 |
2_746 |
32 |
10 |
7650 |
288.6 |
-1.3 |
0.386 |
2 |
0 |
0 |
0.000 |
13 |
|
C |
30 |
10 |
7682 |
◊ |
D |
-x+3,y-1/2,-z+2 |
2_847 |
33 |
11 |
7670 |
268.5 |
-1.7 |
0.324 |
1 |
0 |
0 |
0.000 |
Average: |
278.5 |
-1.5 |
0.355 |
2 |
0 |
0 |
0.000 |
7 |
14 |
|
C |
25 |
11 |
7682 |
◊ |
A |
-x+3,y-1/2,-z+2 |
2_847 |
25 |
11 |
7650 |
219.2 |
-0.8 |
0.441 |
2 |
0 |
0 |
0.000 |
8 |
15 |
|
[GAL]C:1001 |
10 |
1 |
291 |
f |
C |
x,y,z |
1_555 |
20 |
7 |
7682 |
128.0 |
2.1 |
0.332 |
6 |
0 |
0 |
0.031 |
16 |
|
[GAL]A:1001 |
10 |
1 |
291 |
f |
A |
x,y,z |
1_555 |
20 |
7 |
7650 |
127.4 |
2.2 |
0.335 |
6 |
0 |
0 |
0.031 |
Average: |
127.7 |
2.2 |
0.334 |
6 |
0 |
0 |
0.031 |
9 |
17 |
|
[GAL]B:1001 |
10 |
1 |
292 |
f |
B |
x,y,z |
1_555 |
20 |
7 |
7706 |
115.6 |
1.7 |
0.289 |
7 |
0 |
0 |
0.078 |
18 |
|
[GAL]D:1001 |
10 |
1 |
291 |
f |
D |
x,y,z |
1_555 |
20 |
7 |
7670 |
114.7 |
1.7 |
0.289 |
6 |
0 |
0 |
0.078 |
Average: |
115.2 |
1.7 |
0.289 |
7 |
0 |
0 |
0.078 |
10 |
19 |
|
[NAG]B:1002 |
11 |
1 |
360 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
7706 |
110.9 |
3.0 |
0.347 |
3 |
0 |
0 |
0.000 |
20 |
|
[NAG]D:1002 |
11 |
1 |
361 |
f |
D |
x,y,z |
1_555 |
17 |
7 |
7670 |
110.9 |
2.9 |
0.307 |
3 |
0 |
0 |
0.000 |
Average: |
110.9 |
3.0 |
0.327 |
3 |
0 |
0 |
0.000 |
11 |
21 |
|
[PO4]D:1003 |
5 |
1 |
189 |
f |
D |
x,y,z |
1_555 |
20 |
9 |
7670 |
103.2 |
-5.8 |
0.828 |
4 |
0 |
0 |
0.124 |
12 |
22 |
|
[PO4]A:1005 |
5 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
7650 |
103.1 |
-5.8 |
0.740 |
4 |
0 |
0 |
0.400 |
13 |
23 |
|
[PO4]C:1005 |
5 |
1 |
188 |
f |
C |
x,y,z |
1_555 |
19 |
9 |
7682 |
102.3 |
-5.7 |
0.746 |
4 |
0 |
0 |
0.429 |
14 |
24 |
|
[NAG]A:1002 |
9 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
7650 |
98.1 |
2.7 |
0.384 |
3 |
0 |
0 |
0.000 |
25 |
|
[NAG]C:1002 |
9 |
1 |
363 |
f |
C |
x,y,z |
1_555 |
14 |
6 |
7682 |
97.5 |
2.7 |
0.353 |
3 |
0 |
0 |
0.000 |
Average: |
97.8 |
2.7 |
0.368 |
3 |
0 |
0 |
0.000 |
15 |
26 |
|
B |
12 |
4 |
7706 |
◊ |
[NAG]C:1002 |
x-1,y,z-1 |
1_454 |
7 |
1 |
363 |
95.0 |
2.9 |
0.495 |
2 |
0 |
0 |
0.000 |
27 |
|
[NAG]A:1002 |
7 |
1 |
363 |
◊ |
D |
x,y,z |
1_555 |
12 |
4 |
7670 |
88.9 |
2.7 |
0.490 |
2 |
0 |
0 |
0.000 |
Average: |
91.9 |
2.8 |
0.493 |
2 |
0 |
0 |
0.000 |
16 |
28 |
|
C |
13 |
8 |
7682 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
7706 |
94.0 |
-0.8 |
0.367 |
1 |
0 |
0 |
0.000 |
29 |
|
D |
6 |
3 |
7670 |
◊ |
A |
x-1,y,z+1 |
1_456 |
9 |
5 |
7650 |
77.2 |
0.2 |
0.558 |
2 |
0 |
0 |
0.000 |
Average: |
85.6 |
-0.3 |
0.462 |
2 |
0 |
0 |
0.000 |
17 |
30 |
|
[PO4]B:1005 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
7706 |
92.9 |
-5.5 |
0.706 |
3 |
0 |
0 |
0.378 |
18 |
31 |
|
[GAL]D:1001 |
8 |
1 |
291 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
7706 |
92.9 |
2.1 |
0.375 |
2 |
0 |
0 |
0.000 |
32 |
|
[GAL]B:1001 |
8 |
1 |
292 |
◊ |
D |
x,y,z-1 |
1_554 |
12 |
5 |
7670 |
92.5 |
2.2 |
0.391 |
2 |
0 |
0 |
0.000 |
Average: |
92.7 |
2.2 |
0.383 |
2 |
0 |
0 |
0.000 |
19 |
33 |
|
[NAG]D:1002 |
4 |
1 |
361 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
7706 |
68.9 |
1.5 |
0.516 |
2 |
0 |
0 |
0.000 |
34 |
|
[NAG]B:1002 |
5 |
1 |
360 |
◊ |
D |
x,y,z-1 |
1_554 |
9 |
4 |
7670 |
67.1 |
1.5 |
0.461 |
2 |
0 |
0 |
0.000 |
Average: |
68.0 |
1.5 |
0.489 |
2 |
0 |
0 |
0.000 |
20 |
35 |
|
[NAG]A:1002 |
8 |
1 |
363 |
cf |
[GAL]A:1003 |
x,y,z |
1_555 |
7 |
1 |
293 |
67.4 |
2.4 |
0.143 |
0 |
0 |
0 |
0.000 |
36 |
|
[NAG]C:1002 |
8 |
1 |
363 |
cf |
[GAL]C:1003 |
x,y,z |
1_555 |
7 |
1 |
290 |
65.7 |
2.4 |
0.123 |
0 |
0 |
0 |
0.000 |
Average: |
66.6 |
2.4 |
0.133 |
0 |
0 |
0 |
0.000 |
21 |
37 |
|
[NAG]B:1002 |
9 |
1 |
360 |
cf |
[GAL]B:1003 |
x,y,z |
1_555 |
6 |
1 |
290 |
67.3 |
2.4 |
0.135 |
0 |
0 |
0 |
0.000 |
22 |
38 |
|
[BGC]A:1004 |
5 |
1 |
303 |
cf |
[GAL]A:1003 |
x,y,z |
1_555 |
6 |
1 |
293 |
65.0 |
1.1 |
0.150 |
1 |
0 |
0 |
0.000 |
23 |
39 |
|
C |
9 |
6 |
7682 |
◊ |
[GAL]A:1003 |
-x+3,y-1/2,-z+2 |
2_847 |
6 |
1 |
293 |
61.6 |
1.2 |
0.321 |
1 |
0 |
0 |
0.000 |
24 |
40 |
|
[BGC]B:1004 |
5 |
1 |
293 |
cf |
[GAL]B:1003 |
x,y,z |
1_555 |
7 |
1 |
290 |
61.6 |
1.1 |
0.152 |
0 |
0 |
0 |
0.000 |
25 |
41 |
|
[BGC]C:1004 |
4 |
1 |
293 |
cf |
[GAL]C:1003 |
x,y,z |
1_555 |
5 |
1 |
290 |
60.4 |
1.1 |
0.149 |
0 |
0 |
0 |
0.000 |
26 |
42 |
|
[BGC]B:1004 |
6 |
1 |
293 |
◊ |
A |
x-1,y,z |
1_455 |
8 |
3 |
7650 |
59.0 |
1.2 |
0.378 |
1 |
0 |
0 |
0.000 |
27 |
43 |
|
[NAG]A:1002 |
4 |
1 |
363 |
cf |
[GAL]A:1001 |
x,y,z |
1_555 |
6 |
1 |
291 |
55.9 |
1.1 |
0.153 |
0 |
0 |
0 |
0.000 |
44 |
|
[NAG]C:1002 |
4 |
1 |
363 |
cf |
[GAL]C:1001 |
x,y,z |
1_555 |
6 |
1 |
291 |
55.6 |
1.0 |
0.127 |
0 |
0 |
0 |
0.000 |
Average: |
55.8 |
1.0 |
0.140 |
0 |
0 |
0 |
0.000 |
28 |
45 |
|
[NAG]B:1002 |
6 |
1 |
360 |
cf |
[GAL]B:1001 |
x,y,z |
1_555 |
6 |
1 |
292 |
54.6 |
0.8 |
0.112 |
0 |
0 |
0 |
0.000 |
46 |
|
[NAG]D:1002 |
6 |
1 |
361 |
cf |
[GAL]D:1001 |
x,y,z |
1_555 |
7 |
1 |
291 |
54.6 |
0.9 |
0.114 |
0 |
0 |
0 |
0.000 |
Average: |
54.6 |
0.9 |
0.113 |
0 |
0 |
0 |
0.000 |
29 |
47 |
|
C |
5 |
2 |
7682 |
◊ |
[GAL]A:1001 |
-x+3,y-1/2,-z+2 |
2_847 |
5 |
1 |
291 |
48.3 |
0.2 |
0.184 |
2 |
0 |
0 |
0.000 |
48 |
|
[GAL]C:1001 |
5 |
1 |
291 |
◊ |
A |
-x+3,y-1/2,-z+2 |
2_847 |
7 |
3 |
7650 |
47.3 |
0.3 |
0.208 |
2 |
0 |
0 |
0.000 |
Average: |
47.8 |
0.2 |
0.196 |
2 |
0 |
0 |
0.000 |
30 |
49 |
|
B |
7 |
3 |
7706 |
◊ |
[PO4]B:1005 |
x-1,y,z |
1_455 |
5 |
1 |
187 |
47.2 |
-2.1 |
0.758 |
0 |
0 |
0 |
0.000 |
50 |
|
[PO4]D:1003 |
4 |
1 |
189 |
◊ |
D |
x-1,y,z |
1_455 |
9 |
5 |
7670 |
38.2 |
-2.3 |
0.586 |
0 |
0 |
0 |
0.000 |
Average: |
42.7 |
-2.2 |
0.672 |
0 |
0 |
0 |
0.000 |
31 |
51 |
|
[GAL]C:1003 |
6 |
1 |
290 |
◊ |
A |
-x+3,y-1/2,-z+2 |
2_847 |
6 |
4 |
7650 |
46.0 |
1.0 |
0.265 |
0 |
0 |
0 |
0.000 |
32 |
52 |
|
B |
3 |
2 |
7706 |
◊ |
[BGC]C:1004 |
x-1,y,z-1 |
1_454 |
2 |
1 |
293 |
44.5 |
1.2 |
0.724 |
1 |
0 |
0 |
0.000 |
33 |
53 |
|
[BGC]A:1004 |
4 |
1 |
303 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
7670 |
40.1 |
1.2 |
0.492 |
1 |
0 |
0 |
0.000 |
34 |
54 |
|
A |
8 |
4 |
7650 |
◊ |
[PO4]A:1005 |
x-1,y,z |
1_455 |
4 |
1 |
189 |
38.7 |
-2.3 |
0.571 |
0 |
0 |
0 |
0.000 |
35 |
55 |
|
[PO4]C:1005 |
4 |
1 |
188 |
◊ |
C |
x-1,y,z |
1_455 |
6 |
4 |
7682 |
36.8 |
-2.1 |
0.552 |
0 |
0 |
0 |
0.000 |
36 |
56 |
|
D |
8 |
5 |
7670 |
◊ |
A |
x-1,y,z |
1_455 |
4 |
2 |
7650 |
36.7 |
-0.0 |
0.508 |
0 |
0 |
0 |
0.000 |
57 |
|
B |
5 |
3 |
7706 |
◊ |
C |
x,y,z-1 |
1_554 |
3 |
2 |
7682 |
23.6 |
0.0 |
0.517 |
0 |
0 |
0 |
0.000 |
Average: |
30.2 |
0.0 |
0.512 |
0 |
0 |
0 |
0.000 |
37 |
58 |
|
[GAL]B:1003 |
4 |
1 |
290 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
1 |
7650 |
35.1 |
0.3 |
0.183 |
0 |
0 |
0 |
0.000 |
38 |
59 |
|
[GAL]B:1003 |
3 |
1 |
290 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
7706 |
31.9 |
0.4 |
0.268 |
0 |
0 |
0 |
0.000 |
60 |
|
[GAL]C:1003 |
3 |
1 |
290 |
f |
C |
x,y,z |
1_555 |
6 |
2 |
7682 |
29.8 |
0.3 |
0.229 |
0 |
0 |
0 |
0.000 |
61 |
|
[GAL]A:1003 |
3 |
1 |
293 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
7650 |
25.2 |
0.3 |
0.242 |
0 |
0 |
0 |
0.000 |
Average: |
28.9 |
0.3 |
0.246 |
0 |
0 |
0 |
0.000 |
39 |
62 |
|
B |
3 |
3 |
7706 |
◊ |
[GAL]C:1003 |
x-1,y,z-1 |
1_454 |
4 |
1 |
290 |
31.8 |
0.7 |
0.303 |
0 |
0 |
0 |
0.000 |
40 |
63 |
|
C |
5 |
4 |
7682 |
◊ |
[NAG]A:1002 |
-x+3,y-1/2,-z+2 |
2_847 |
3 |
1 |
363 |
31.1 |
0.3 |
0.308 |
0 |
0 |
0 |
0.000 |
64 |
|
[NAG]C:1002 |
3 |
1 |
363 |
◊ |
A |
-x+3,y-1/2,-z+2 |
2_847 |
6 |
4 |
7650 |
30.4 |
0.3 |
0.313 |
0 |
0 |
0 |
0.000 |
Average: |
30.8 |
0.3 |
0.310 |
0 |
0 |
0 |
0.000 |
41 |
65 |
|
[GAL]B:1003 |
4 |
1 |
290 |
◊ |
D |
x,y,z-1 |
1_554 |
6 |
4 |
7670 |
27.1 |
0.8 |
0.407 |
0 |
0 |
0 |
0.000 |
42 |
66 |
|
[GAL]A:1001 |
5 |
1 |
291 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
7670 |
25.8 |
1.0 |
0.353 |
0 |
0 |
0 |
0.000 |
67 |
|
B |
2 |
1 |
7706 |
◊ |
[GAL]C:1001 |
x-1,y,z-1 |
1_454 |
5 |
1 |
291 |
25.5 |
1.0 |
0.352 |
0 |
0 |
0 |
0.000 |
Average: |
25.6 |
1.0 |
0.352 |
0 |
0 |
0 |
0.000 |
43 |
68 |
|
C |
3 |
1 |
7682 |
◊ |
[BGC]A:1004 |
-x+3,y-1/2,-z+2 |
2_847 |
4 |
1 |
303 |
22.5 |
0.6 |
0.372 |
0 |
0 |
0 |
0.000 |
44 |
69 |
|
[GAL]A:1003 |
3 |
1 |
293 |
◊ |
D |
x,y,z |
1_555 |
4 |
3 |
7670 |
18.1 |
0.5 |
0.443 |
0 |
0 |
0 |
0.000 |
45 |
70 |
|
[PO4]B:1005 |
4 |
1 |
187 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
7682 |
15.7 |
-0.5 |
0.858 |
0 |
0 |
0 |
0.000 |
46 |
71 |
|
[BGC]C:1004 |
3 |
1 |
293 |
◊ |
A |
-x+3,y-1/2,-z+2 |
2_847 |
3 |
1 |
7650 |
12.9 |
0.3 |
0.358 |
0 |
0 |
0 |
0.000 |
47 |
72 |
|
[BGC]A:1004 |
2 |
1 |
303 |
f |
[NAG]A:1002 |
x,y,z |
1_555 |
3 |
1 |
363 |
8.7 |
0.4 |
0.251 |
0 |
0 |
0 |
0.000 |
48 |
73 |
|
[BGC]B:1004 |
2 |
1 |
293 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
3 |
7706 |
6.7 |
0.2 |
0.422 |
0 |
0 |
0 |
0.000 |
49 |
74 |
|
[BGC]B:1004 |
1 |
1 |
293 |
◊ |
D |
x-1,y,z-1 |
1_454 |
1 |
1 |
7670 |
5.4 |
0.1 |
0.367 |
0 |
0 |
0 |
0.000 |
50 |
75 |
|
[BGC]B:1004 |
1 |
1 |
293 |
f |
[NAG]B:1002 |
x,y,z |
1_555 |
3 |
1 |
360 |
2.8 |
0.0 |
0.204 |
0 |
0 |
0 |
0.000 |
51 |
76 |
|
[BGC]B:1004 |
1 |
1 |
293 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
7706 |
2.7 |
0.0 |
0.376 |
0 |
0 |
0 |
0.000 |
52 |
77 |
|
B |
1 |
1 |
7706 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
7650 |
2.5 |
0.1 |
0.698 |
0 |
0 |
0 |
0.000 |
53 |
78 |
|
[BGC]C:1004 |
1 |
1 |
293 |
f |
C |
x,y,z |
1_555 |
1 |
1 |
7682 |
1.1 |
0.0 |
0.355 |
0 |
0 |
0 |
0.000 |
54 |
79 |
|
[BGC]C:1004 |
1 |
1 |
293 |
f |
[NAG]C:1002 |
x,y,z |
1_555 |
1 |
1 |
363 |
1.0 |
0.0 |
0.161 |
0 |
0 |
0 |
0.000 |
55 |
80 |
|
C |
1 |
1 |
7682 |
◊ |
D |
-x+2,y-1/2,-z+2 |
2_747 |
1 |
1 |
7670 |
0.7 |
0.0 |
0.567 |
0 |
0 |
0 |
0.000 |
|