## |
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 |
|
E |
244 |
60 |
13956 |
◊ |
A |
x,y,z |
1_555 |
232 |
66 |
13981 |
2282.4 |
-25.2 |
0.103 |
35 |
5 |
0 |
1.000 |
2 |
|
B |
229 |
65 |
13988 |
◊ |
A |
x,y,z |
1_555 |
242 |
58 |
13981 |
2266.3 |
-27.2 |
0.090 |
37 |
5 |
0 |
1.000 |
3 |
|
D |
227 |
66 |
14345 |
◊ |
C |
x,y,z |
1_555 |
242 |
59 |
14334 |
2250.2 |
-25.3 |
0.113 |
39 |
4 |
0 |
1.000 |
4 |
|
E |
225 |
66 |
13956 |
◊ |
D |
x,y,z |
1_555 |
237 |
57 |
14345 |
2249.6 |
-26.1 |
0.087 |
34 |
4 |
0 |
1.000 |
5 |
|
C |
228 |
66 |
14334 |
◊ |
B |
x,y,z |
1_555 |
245 |
59 |
13988 |
2245.4 |
-26.2 |
0.116 |
39 |
4 |
0 |
1.000 |
Average: |
2258.8 |
-26.0 |
0.102 |
37 |
4 |
0 |
1.000 |
2 |
6 |
|
D |
37 |
14 |
14345 |
◊ |
C |
-x+1/2,y-1/2,-z+1 |
4_546 |
41 |
14 |
14334 |
335.1 |
-0.8 |
0.684 |
4 |
0 |
0 |
0.000 |
3 |
7 |
|
C |
34 |
11 |
14334 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
40 |
11 |
13981 |
294.2 |
-1.0 |
0.641 |
9 |
1 |
0 |
0.057 |
8 |
|
E |
35 |
10 |
13956 |
◊ |
D |
-x+1,y,-z+1 |
2_656 |
29 |
8 |
14345 |
276.8 |
-0.6 |
0.631 |
9 |
1 |
0 |
0.057 |
9 |
|
B |
33 |
9 |
13988 |
◊ |
B |
-x+1,y,-z+1 |
2_656 |
33 |
9 |
13988 |
261.2 |
-0.6 |
0.691 |
10 |
2 |
0 |
0.057 |
Average: |
277.4 |
-0.7 |
0.654 |
9 |
1 |
0 |
0.057 |
4 |
10 |
|
[SIA]B:1 |
16 |
1 |
434 |
f |
B |
x,y,z |
1_555 |
31 |
12 |
13988 |
217.0 |
-1.7 |
0.399 |
5 |
0 |
0 |
0.042 |
11 |
|
[SIA]C:1 |
16 |
1 |
436 |
f |
C |
x,y,z |
1_555 |
32 |
12 |
14334 |
216.5 |
-1.6 |
0.412 |
7 |
0 |
0 |
0.042 |
Average: |
216.8 |
-1.7 |
0.406 |
6 |
0 |
0 |
0.042 |
5 |
12 |
|
E |
27 |
9 |
13956 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
17 |
6 |
13988 |
215.8 |
1.5 |
0.834 |
3 |
6 |
0 |
0.000 |
6 |
13 |
|
[GOL]D:2 |
6 |
1 |
219 |
f |
D |
x,y,z |
1_555 |
22 |
9 |
14345 |
128.4 |
-0.0 |
0.640 |
5 |
0 |
0 |
1.000 |
7 |
14 |
|
[GOL]B:290 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
21 |
9 |
13988 |
126.2 |
-0.4 |
0.607 |
5 |
0 |
0 |
0.013 |
8 |
15 |
|
[GOL]C:290 |
6 |
1 |
217 |
f |
C |
x,y,z |
1_555 |
21 |
9 |
14334 |
126.2 |
-0.4 |
0.587 |
4 |
0 |
0 |
0.100 |
16 |
|
[GOL]A:4 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
13981 |
125.6 |
-0.2 |
0.590 |
5 |
0 |
0 |
0.100 |
Average: |
125.9 |
-0.3 |
0.588 |
5 |
0 |
0 |
0.100 |
9 |
17 |
|
E |
15 |
6 |
13956 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
13 |
5 |
13981 |
125.0 |
0.6 |
0.736 |
3 |
0 |
0 |
0.000 |
10 |
18 |
|
D |
14 |
4 |
14345 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
12 |
6 |
13988 |
123.0 |
2.6 |
0.924 |
1 |
0 |
0 |
0.000 |
11 |
19 |
|
[EDO]A:6 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
19 |
8 |
13981 |
106.2 |
2.9 |
0.480 |
2 |
0 |
0 |
0.000 |
12 |
20 |
|
[GOL]E:3 |
6 |
1 |
218 |
f |
E |
x,y,z |
1_555 |
21 |
9 |
13956 |
104.4 |
0.3 |
0.657 |
6 |
0 |
0 |
0.326 |
13 |
21 |
|
[EDO]C:291 |
4 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
16 |
6 |
14334 |
96.5 |
2.7 |
0.467 |
2 |
0 |
0 |
0.000 |
14 |
22 |
|
[EDO]D:290 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
15 |
6 |
14345 |
95.3 |
2.4 |
0.449 |
2 |
0 |
0 |
0.000 |
15 |
23 |
|
[EDO]A:5 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
13981 |
95.1 |
2.6 |
0.448 |
1 |
0 |
0 |
0.000 |
16 |
24 |
|
[EDO]E:290 |
4 |
1 |
184 |
◊ |
E |
x,y,z |
1_555 |
16 |
6 |
13956 |
94.4 |
2.2 |
0.257 |
2 |
0 |
0 |
0.000 |
17 |
25 |
|
[NAG]C:3 |
9 |
1 |
363 |
f |
C |
x,y,z |
1_555 |
13 |
4 |
14334 |
93.9 |
1.3 |
0.284 |
1 |
0 |
0 |
0.000 |
26 |
|
[NAG]B:3 |
9 |
1 |
361 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
13988 |
93.8 |
1.3 |
0.270 |
1 |
0 |
0 |
0.000 |
Average: |
93.9 |
1.3 |
0.277 |
1 |
0 |
0 |
0.000 |
18 |
27 |
|
C |
9 |
4 |
14334 |
◊ |
E |
x-1/2,y+1/2,z |
3_455 |
10 |
4 |
13956 |
86.7 |
1.0 |
0.646 |
1 |
0 |
0 |
0.000 |
28 |
|
D |
9 |
5 |
14345 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
11 |
5 |
13981 |
85.5 |
0.8 |
0.659 |
1 |
0 |
0 |
0.000 |
Average: |
86.1 |
0.9 |
0.653 |
1 |
0 |
0 |
0.000 |
19 |
29 |
|
[EDO]E:4 |
4 |
1 |
184 |
◊ |
E |
x,y,z |
1_555 |
7 |
3 |
13956 |
68.9 |
0.8 |
0.542 |
1 |
0 |
0 |
0.000 |
20 |
30 |
|
[NAG]B:3 |
6 |
1 |
361 |
cf |
[GAL]B:2 |
x,y,z |
1_555 |
6 |
1 |
292 |
66.7 |
1.5 |
0.114 |
1 |
0 |
0 |
0.000 |
31 |
|
[NAG]C:3 |
6 |
1 |
363 |
cf |
[GAL]C:2 |
x,y,z |
1_555 |
6 |
1 |
289 |
66.3 |
1.4 |
0.117 |
1 |
0 |
0 |
0.000 |
Average: |
66.5 |
1.5 |
0.116 |
1 |
0 |
0 |
0.000 |
21 |
32 |
|
[NAG]B:3 |
10 |
1 |
361 |
cf |
[GAL]B:4 |
x,y,z |
1_555 |
6 |
1 |
291 |
62.6 |
2.3 |
0.109 |
1 |
0 |
0 |
0.000 |
33 |
|
[NAG]C:3 |
10 |
1 |
363 |
cf |
[GAL]C:4 |
x,y,z |
1_555 |
6 |
1 |
291 |
61.7 |
2.3 |
0.109 |
1 |
0 |
0 |
0.000 |
Average: |
62.2 |
2.3 |
0.109 |
1 |
0 |
0 |
0.000 |
22 |
34 |
|
[GAL]C:4 |
6 |
1 |
291 |
cf |
[BGC]C:5 |
x,y,z |
1_555 |
5 |
1 |
303 |
61.0 |
1.0 |
0.123 |
1 |
0 |
0 |
0.000 |
35 |
|
[GAL]B:4 |
6 |
1 |
291 |
cf |
[BGC]B:5 |
x,y,z |
1_555 |
6 |
1 |
307 |
60.0 |
1.0 |
0.088 |
0 |
0 |
0 |
0.000 |
Average: |
60.5 |
1.0 |
0.105 |
1 |
0 |
0 |
0.000 |
23 |
36 |
|
[GAL]B:2 |
6 |
1 |
292 |
cf |
[SIA]B:1 |
x,y,z |
1_555 |
8 |
1 |
434 |
60.8 |
2.1 |
0.350 |
0 |
0 |
0 |
0.000 |
37 |
|
[GAL]C:2 |
6 |
1 |
289 |
cf |
[SIA]C:1 |
x,y,z |
1_555 |
8 |
1 |
436 |
60.5 |
2.1 |
0.351 |
0 |
0 |
0 |
0.000 |
Average: |
60.7 |
2.1 |
0.350 |
0 |
0 |
0 |
0.000 |
24 |
38 |
|
[SIA]C:1 |
6 |
1 |
436 |
◊ |
D |
x,y,z |
1_555 |
10 |
3 |
14345 |
57.7 |
-1.2 |
0.329 |
0 |
0 |
0 |
0.012 |
39 |
|
[SIA]B:1 |
6 |
1 |
434 |
◊ |
C |
x,y,z |
1_555 |
10 |
3 |
14334 |
57.6 |
-1.3 |
0.312 |
0 |
0 |
0 |
0.012 |
Average: |
57.6 |
-1.3 |
0.321 |
0 |
0 |
0 |
0.012 |
25 |
40 |
|
E |
7 |
3 |
13956 |
◊ |
[GAL]B:2 |
-x+1/2,y-1/2,-z |
4_545 |
6 |
1 |
292 |
53.4 |
0.7 |
0.197 |
0 |
0 |
0 |
0.000 |
26 |
41 |
|
[GAL]C:4 |
6 |
1 |
291 |
f |
C |
x,y,z |
1_555 |
7 |
2 |
14334 |
49.1 |
0.1 |
0.170 |
0 |
0 |
0 |
0.000 |
42 |
|
[GAL]B:4 |
6 |
1 |
291 |
f |
B |
x,y,z |
1_555 |
7 |
2 |
13988 |
48.2 |
0.1 |
0.165 |
0 |
0 |
0 |
0.000 |
Average: |
48.7 |
0.1 |
0.167 |
0 |
0 |
0 |
0.000 |
27 |
43 |
|
[NAG]C:3 |
7 |
1 |
363 |
f |
[SIA]C:1 |
x,y,z |
1_555 |
6 |
1 |
436 |
47.6 |
1.0 |
0.232 |
0 |
0 |
0 |
0.000 |
44 |
|
[NAG]B:3 |
7 |
1 |
361 |
f |
[SIA]B:1 |
x,y,z |
1_555 |
6 |
1 |
434 |
46.9 |
0.8 |
0.222 |
0 |
0 |
0 |
0.000 |
Average: |
47.2 |
0.9 |
0.227 |
0 |
0 |
0 |
0.000 |
28 |
45 |
|
[GOL]E:3 |
4 |
1 |
218 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
5 |
2 |
13988 |
42.7 |
-0.7 |
0.372 |
0 |
0 |
0 |
0.000 |
29 |
46 |
|
D |
5 |
1 |
14345 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
4 |
2 |
13981 |
40.2 |
-0.3 |
0.306 |
0 |
0 |
0 |
0.000 |
30 |
47 |
|
[NAG]B:3 |
3 |
1 |
361 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
14334 |
38.9 |
1.3 |
0.550 |
0 |
0 |
0 |
0.000 |
48 |
|
[NAG]C:3 |
2 |
1 |
363 |
◊ |
D |
x,y,z |
1_555 |
5 |
3 |
14345 |
38.2 |
1.3 |
0.626 |
0 |
0 |
0 |
0.000 |
Average: |
38.5 |
1.3 |
0.588 |
0 |
0 |
0 |
0.000 |
31 |
49 |
|
[GOL]D:2 |
4 |
1 |
219 |
◊ |
C |
x,y,z |
1_555 |
4 |
1 |
14334 |
37.2 |
0.1 |
0.649 |
2 |
0 |
0 |
0.007 |
50 |
|
[GOL]B:290 |
4 |
1 |
219 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
13981 |
36.5 |
0.1 |
0.662 |
2 |
0 |
0 |
0.007 |
Average: |
36.9 |
0.1 |
0.655 |
2 |
0 |
0 |
0.007 |
32 |
51 |
|
[GOL]A:4 |
4 |
1 |
219 |
◊ |
E |
x,y,z |
1_555 |
5 |
1 |
13956 |
37.2 |
0.1 |
0.647 |
2 |
0 |
0 |
0.008 |
52 |
|
[GOL]C:290 |
4 |
1 |
217 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
13988 |
35.9 |
0.1 |
0.637 |
2 |
0 |
0 |
0.008 |
Average: |
36.5 |
0.1 |
0.642 |
2 |
0 |
0 |
0.008 |
33 |
53 |
|
[GOL]E:3 |
3 |
1 |
218 |
◊ |
D |
x,y,z |
1_555 |
7 |
2 |
14345 |
32.3 |
0.3 |
0.662 |
2 |
0 |
0 |
0.003 |
34 |
54 |
|
[GAL]B:2 |
6 |
1 |
292 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
13988 |
26.4 |
0.7 |
0.227 |
0 |
0 |
0 |
0.000 |
55 |
|
[GAL]C:2 |
4 |
1 |
289 |
f |
C |
x,y,z |
1_555 |
4 |
2 |
14334 |
26.2 |
0.7 |
0.347 |
0 |
0 |
0 |
0.000 |
Average: |
26.3 |
0.7 |
0.287 |
0 |
0 |
0 |
0.000 |
35 |
56 |
|
[EDO]E:4 |
2 |
1 |
184 |
f |
[EDO]E:290 |
x,y,z |
1_555 |
2 |
1 |
184 |
25.8 |
1.3 |
1.000 |
0 |
0 |
0 |
0.000 |
36 |
57 |
|
[GOL]E:3 |
3 |
1 |
218 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
3 |
1 |
13981 |
24.8 |
0.6 |
0.597 |
0 |
0 |
0 |
0.000 |
37 |
58 |
|
[BGC]C:5 |
3 |
1 |
303 |
f |
C |
x,y,z |
1_555 |
3 |
1 |
14334 |
23.7 |
0.5 |
0.274 |
0 |
0 |
0 |
0.000 |
59 |
|
[BGC]B:5 |
3 |
1 |
307 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
13988 |
19.5 |
0.2 |
0.243 |
0 |
0 |
0 |
0.000 |
Average: |
21.6 |
0.3 |
0.259 |
0 |
0 |
0 |
0.000 |
38 |
60 |
|
[EDO]D:290 |
1 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
5 |
2 |
14334 |
18.6 |
1.1 |
0.963 |
0 |
0 |
0 |
0.000 |
39 |
61 |
|
[EDO]A:6 |
2 |
1 |
186 |
f |
[EDO]A:5 |
x,y,z |
1_555 |
1 |
1 |
185 |
17.9 |
0.6 |
1.000 |
0 |
0 |
0 |
0.000 |
40 |
62 |
|
[EDO]C:291 |
2 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
13988 |
15.8 |
1.0 |
0.957 |
0 |
0 |
0 |
0.000 |
41 |
63 |
|
E |
2 |
1 |
13956 |
x |
E |
-x+1/2,y-1/2,-z |
4_545 |
1 |
1 |
13956 |
14.1 |
0.2 |
0.737 |
0 |
0 |
0 |
0.000 |
42 |
64 |
|
E |
2 |
1 |
13956 |
◊ |
[NAG]B:3 |
-x+1/2,y-1/2,-z |
4_545 |
1 |
1 |
361 |
11.1 |
-0.2 |
0.323 |
0 |
0 |
0 |
0.000 |
43 |
65 |
|
[EDO]E:290 |
1 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
3 |
2 |
14345 |
10.3 |
0.9 |
0.973 |
0 |
0 |
0 |
0.000 |
44 |
66 |
|
[EDO]A:5 |
1 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
3 |
2 |
13956 |
10.2 |
1.0 |
0.974 |
0 |
0 |
0 |
0.000 |
45 |
67 |
|
[NAG]B:3 |
1 |
1 |
361 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
13981 |
9.9 |
0.2 |
0.487 |
0 |
0 |
0 |
0.000 |
68 |
|
[NAG]C:3 |
1 |
1 |
363 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
13988 |
9.7 |
0.2 |
0.488 |
0 |
0 |
0 |
0.000 |
Average: |
9.8 |
0.2 |
0.487 |
0 |
0 |
0 |
0.000 |
46 |
69 |
|
[GAL]B:4 |
2 |
1 |
291 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
14334 |
7.2 |
0.2 |
0.463 |
0 |
0 |
0 |
0.000 |
70 |
|
[GAL]C:4 |
2 |
1 |
291 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
14345 |
6.1 |
0.1 |
0.458 |
0 |
0 |
0 |
0.000 |
Average: |
6.7 |
0.2 |
0.460 |
0 |
0 |
0 |
0.000 |
47 |
71 |
|
[BGC]B:5 |
3 |
1 |
307 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
14334 |
2.4 |
0.1 |
0.330 |
0 |
0 |
0 |
0.000 |
48 |
72 |
|
[EDO]E:4 |
1 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
1 |
1 |
14345 |
1.3 |
0.1 |
0.835 |
0 |
0 |
0 |
0.000 |
49 |
73 |
|
[NAG]B:3 |
1 |
1 |
361 |
f |
[BGC]B:5 |
x,y,z |
1_555 |
1 |
1 |
307 |
0.3 |
0.0 |
0.154 |
0 |
0 |
0 |
0.000 |
74 |
|
[NAG]C:3 |
1 |
1 |
363 |
f |
[BGC]C:5 |
x,y,z |
1_555 |
1 |
1 |
303 |
0.1 |
0.0 |
0.154 |
0 |
0 |
0 |
0.000 |
Average: |
0.2 |
0.0 |
0.154 |
0 |
0 |
0 |
0.000 |
50 |
75 |
|
[GAL]B:2 |
1 |
1 |
292 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
13981 |
0.3 |
0.0 |
0.340 |
0 |
0 |
0 |
0.000 |
|