## |
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 |
159 |
52 |
14151 |
◊ |
A |
x,y,z |
1_555 |
160 |
50 |
14292 |
1536.5 |
-1.3 |
0.630 |
24 |
11 |
0 |
0.500 |
2 |
|
F |
154 |
50 |
14345 |
◊ |
C |
x,y,z |
1_555 |
152 |
46 |
14067 |
1513.0 |
-2.3 |
0.566 |
26 |
10 |
0 |
0.500 |
3 |
|
D |
156 |
50 |
14292 |
◊ |
B |
x,y,z |
1_555 |
159 |
49 |
14306 |
1511.8 |
-2.2 |
0.550 |
25 |
10 |
0 |
0.500 |
Average: |
1520.4 |
-1.9 |
0.582 |
25 |
10 |
0 |
0.500 |
2 |
4 |
|
F |
105 |
30 |
14345 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
104 |
31 |
14292 |
937.5 |
-1.7 |
0.535 |
7 |
6 |
0 |
0.000 |
5 |
|
D |
100 |
29 |
14292 |
◊ |
E |
-x+1,y-1/2,-z |
2_645 |
104 |
30 |
14151 |
923.8 |
-2.9 |
0.486 |
5 |
8 |
0 |
0.000 |
Average: |
930.7 |
-2.3 |
0.511 |
6 |
7 |
0 |
0.000 |
3 |
6 |
|
F |
73 |
24 |
14345 |
◊ |
B |
x,y,z |
1_555 |
65 |
21 |
14306 |
635.2 |
-0.2 |
0.517 |
8 |
3 |
0 |
0.000 |
7 |
|
B |
70 |
23 |
14306 |
◊ |
A |
x,y,z |
1_555 |
69 |
21 |
14292 |
625.7 |
-0.3 |
0.353 |
8 |
3 |
0 |
0.000 |
Average: |
630.5 |
-0.3 |
0.435 |
8 |
3 |
0 |
0.000 |
4 |
8 |
|
C |
65 |
23 |
14067 |
◊ |
B |
x-1,y,z |
1_455 |
73 |
23 |
14306 |
630.5 |
-0.4 |
0.569 |
7 |
9 |
0 |
0.000 |
5 |
9 |
|
[NDP]B:1340 |
46 |
1 |
885 |
f |
B |
x,y,z |
1_555 |
71 |
28 |
14306 |
579.0 |
-3.2 |
0.467 |
19 |
0 |
0 |
0.772 |
10 |
|
[NDP]A:1340 |
47 |
1 |
890 |
f |
A |
x,y,z |
1_555 |
70 |
29 |
14292 |
578.9 |
-3.4 |
0.455 |
18 |
0 |
0 |
0.772 |
11 |
|
[NDP]D:1340 |
47 |
1 |
885 |
f |
D |
x,y,z |
1_555 |
70 |
27 |
14292 |
578.3 |
-3.5 |
0.455 |
19 |
0 |
0 |
0.772 |
12 |
|
[NDP]E:1340 |
47 |
1 |
887 |
f |
E |
x,y,z |
1_555 |
69 |
27 |
14151 |
578.1 |
-3.3 |
0.471 |
18 |
0 |
0 |
0.772 |
13 |
|
[NDP]F:1340 |
45 |
1 |
886 |
f |
F |
x,y,z |
1_555 |
70 |
28 |
14345 |
576.6 |
-2.9 |
0.476 |
19 |
0 |
0 |
0.772 |
14 |
|
[NDP]C:1340 |
46 |
1 |
887 |
f |
C |
x,y,z |
1_555 |
69 |
28 |
14067 |
576.0 |
-3.3 |
0.459 |
17 |
0 |
0 |
0.772 |
Average: |
577.8 |
-3.3 |
0.464 |
18 |
0 |
0 |
0.772 |
6 |
15 |
|
D |
29 |
9 |
14292 |
◊ |
A |
x,y,z |
1_555 |
23 |
8 |
14292 |
255.4 |
-3.6 |
0.140 |
0 |
0 |
0 |
0.000 |
16 |
|
C |
23 |
7 |
14067 |
◊ |
B |
x,y,z |
1_555 |
15 |
7 |
14306 |
189.7 |
-3.3 |
0.090 |
0 |
0 |
0 |
0.000 |
Average: |
222.6 |
-3.5 |
0.115 |
0 |
0 |
0 |
0.000 |
7 |
17 |
|
F |
27 |
11 |
14345 |
◊ |
A |
x,y,z |
1_555 |
22 |
7 |
14292 |
205.0 |
-0.1 |
0.535 |
1 |
1 |
0 |
0.000 |
8 |
18 |
|
E |
17 |
7 |
14151 |
◊ |
D |
x,y,z |
1_555 |
20 |
10 |
14292 |
179.2 |
0.6 |
0.496 |
1 |
1 |
0 |
0.000 |
9 |
19 |
|
[BGC]D:1343 |
12 |
1 |
303 |
f |
D |
x,y,z |
1_555 |
36 |
12 |
14292 |
159.9 |
2.5 |
0.464 |
6 |
0 |
0 |
0.006 |
20 |
|
[BGC]A:1343 |
12 |
1 |
303 |
f |
A |
x,y,z |
1_555 |
36 |
12 |
14292 |
158.7 |
2.6 |
0.489 |
6 |
0 |
0 |
0.006 |
21 |
|
[BGC]E:1343 |
12 |
1 |
303 |
f |
E |
x,y,z |
1_555 |
35 |
12 |
14151 |
158.6 |
2.6 |
0.482 |
5 |
0 |
0 |
0.006 |
22 |
|
[BGC]C:1343 |
12 |
1 |
301 |
f |
C |
x,y,z |
1_555 |
36 |
12 |
14067 |
158.6 |
2.6 |
0.477 |
6 |
0 |
0 |
0.006 |
Average: |
159.0 |
2.6 |
0.478 |
6 |
0 |
0 |
0.006 |
10 |
23 |
|
[MLI]F:1341 |
7 |
1 |
226 |
f |
F |
x,y,z |
1_555 |
21 |
9 |
14345 |
130.4 |
3.8 |
0.186 |
7 |
0 |
0 |
0.000 |
11 |
24 |
|
[MLI]B:1342 |
7 |
1 |
225 |
f |
B |
x,y,z |
1_555 |
20 |
8 |
14306 |
124.6 |
3.9 |
0.347 |
6 |
0 |
0 |
0.000 |
12 |
25 |
|
[GLC]D:1342 |
11 |
1 |
294 |
f |
D |
x,y,z |
1_555 |
20 |
9 |
14292 |
115.8 |
1.9 |
0.280 |
1 |
0 |
0 |
0.000 |
26 |
|
[GLC]C:1341 |
11 |
1 |
295 |
f |
C |
x,y,z |
1_555 |
22 |
10 |
14067 |
114.3 |
1.9 |
0.285 |
1 |
0 |
0 |
0.000 |
27 |
|
[GLC]A:1341 |
11 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
14292 |
114.2 |
1.8 |
0.267 |
1 |
0 |
0 |
0.000 |
28 |
|
[GLC]E:1341 |
10 |
1 |
294 |
f |
E |
x,y,z |
1_555 |
21 |
10 |
14151 |
109.0 |
1.8 |
0.306 |
1 |
0 |
0 |
0.000 |
Average: |
113.3 |
1.8 |
0.285 |
1 |
0 |
0 |
0.000 |
13 |
29 |
|
[MLI]B:1341 |
7 |
1 |
225 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
14306 |
104.9 |
1.8 |
0.046 |
2 |
0 |
0 |
0.000 |
14 |
30 |
|
D |
9 |
4 |
14292 |
◊ |
C |
x,y,z |
1_555 |
13 |
8 |
14067 |
93.7 |
0.9 |
0.543 |
1 |
1 |
0 |
0.000 |
15 |
31 |
|
[GLC]C:1342 |
6 |
1 |
292 |
f |
C |
x,y,z |
1_555 |
12 |
7 |
14067 |
83.7 |
1.2 |
0.338 |
0 |
0 |
0 |
0.000 |
16 |
32 |
|
[GLC]D:1341 |
6 |
1 |
292 |
f |
D |
x,y,z |
1_555 |
13 |
7 |
14292 |
83.1 |
1.0 |
0.334 |
0 |
0 |
0 |
0.000 |
33 |
|
[GLC]A:1342 |
6 |
1 |
293 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
14292 |
82.2 |
0.9 |
0.321 |
0 |
0 |
0 |
0.000 |
34 |
|
[GLC]E:1342 |
6 |
1 |
291 |
f |
E |
x,y,z |
1_555 |
12 |
7 |
14151 |
81.9 |
0.9 |
0.329 |
0 |
0 |
0 |
0.000 |
Average: |
82.4 |
1.0 |
0.328 |
0 |
0 |
0 |
0.000 |
17 |
35 |
|
C |
11 |
4 |
14067 |
◊ |
[MLI]B:1341 |
x-1,y,z |
1_455 |
7 |
1 |
225 |
79.6 |
1.5 |
0.730 |
1 |
0 |
0 |
0.000 |
18 |
36 |
|
[GLC]A:1342 |
6 |
1 |
293 |
cf |
[GLC]A:1341 |
x,y,z |
1_555 |
7 |
1 |
294 |
70.3 |
1.7 |
0.144 |
0 |
0 |
0 |
0.000 |
37 |
|
[GLC]E:1342 |
6 |
1 |
291 |
cf |
[GLC]E:1341 |
x,y,z |
1_555 |
6 |
1 |
294 |
69.8 |
1.6 |
0.185 |
0 |
0 |
0 |
0.000 |
38 |
|
[GLC]C:1342 |
6 |
1 |
292 |
cf |
[GLC]C:1341 |
x,y,z |
1_555 |
6 |
1 |
295 |
69.8 |
1.6 |
0.144 |
0 |
0 |
0 |
0.000 |
39 |
|
[GLC]D:1342 |
7 |
1 |
294 |
cf |
[GLC]D:1341 |
x,y,z |
1_555 |
6 |
1 |
292 |
68.3 |
1.8 |
0.161 |
0 |
0 |
0 |
0.000 |
Average: |
69.6 |
1.7 |
0.159 |
0 |
0 |
0 |
0.000 |
19 |
40 |
|
[BGC]E:1343 |
6 |
1 |
303 |
cf |
[GLC]E:1341 |
x,y,z |
1_555 |
7 |
1 |
294 |
63.4 |
1.8 |
0.150 |
1 |
0 |
0 |
0.000 |
41 |
|
[BGC]D:1343 |
6 |
1 |
303 |
cf |
[GLC]D:1342 |
x,y,z |
1_555 |
6 |
1 |
294 |
63.4 |
1.8 |
0.180 |
1 |
0 |
0 |
0.000 |
42 |
|
[BGC]C:1343 |
6 |
1 |
301 |
cf |
[GLC]C:1341 |
x,y,z |
1_555 |
8 |
1 |
295 |
62.5 |
1.8 |
0.136 |
1 |
0 |
0 |
0.000 |
43 |
|
[BGC]A:1343 |
6 |
1 |
303 |
cf |
[GLC]A:1341 |
x,y,z |
1_555 |
8 |
1 |
294 |
62.2 |
1.8 |
0.132 |
1 |
0 |
0 |
0.000 |
Average: |
62.9 |
1.8 |
0.149 |
1 |
0 |
0 |
0.000 |
20 |
44 |
|
[MLI]B:1342 |
7 |
1 |
225 |
f |
[NDP]B:1340 |
x,y,z |
1_555 |
11 |
1 |
885 |
63.2 |
0.1 |
0.620 |
0 |
0 |
0 |
0.000 |
21 |
45 |
|
[MLI]F:1341 |
6 |
1 |
226 |
f |
[NDP]F:1340 |
x,y,z |
1_555 |
10 |
1 |
886 |
62.5 |
0.3 |
0.612 |
0 |
0 |
0 |
0.000 |
22 |
46 |
|
[BGC]A:1343 |
7 |
1 |
303 |
f |
[NDP]A:1340 |
x,y,z |
1_555 |
11 |
1 |
890 |
61.1 |
0.1 |
0.305 |
0 |
0 |
0 |
0.000 |
47 |
|
[BGC]C:1343 |
7 |
1 |
301 |
f |
[NDP]C:1340 |
x,y,z |
1_555 |
10 |
1 |
887 |
61.0 |
0.1 |
0.294 |
0 |
0 |
0 |
0.000 |
48 |
|
[BGC]D:1343 |
7 |
1 |
303 |
f |
[NDP]D:1340 |
x,y,z |
1_555 |
10 |
1 |
885 |
61.0 |
0.1 |
0.294 |
0 |
0 |
0 |
0.000 |
49 |
|
[BGC]E:1343 |
7 |
1 |
303 |
f |
[NDP]E:1340 |
x,y,z |
1_555 |
10 |
1 |
887 |
60.3 |
0.1 |
0.296 |
0 |
0 |
0 |
0.000 |
Average: |
60.8 |
0.1 |
0.297 |
0 |
0 |
0 |
0.000 |
23 |
50 |
|
E |
6 |
3 |
14151 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
14067 |
58.4 |
-1.0 |
0.277 |
0 |
0 |
0 |
0.000 |
24 |
51 |
|
[NDP]C:1340 |
3 |
1 |
887 |
◊ |
B |
x-1,y,z |
1_455 |
5 |
2 |
14306 |
54.0 |
0.5 |
0.527 |
1 |
0 |
0 |
0.000 |
25 |
52 |
|
C |
4 |
2 |
14067 |
◊ |
[NDP]B:1340 |
x-1,y,z |
1_455 |
2 |
1 |
885 |
31.3 |
1.0 |
0.835 |
1 |
0 |
0 |
0.000 |
26 |
53 |
|
[MLI]B:1341 |
3 |
1 |
225 |
f |
[NDP]B:1340 |
x,y,z |
1_555 |
2 |
1 |
885 |
7.8 |
0.2 |
0.722 |
0 |
0 |
0 |
0.000 |
27 |
54 |
|
[BGC]A:1343 |
3 |
1 |
303 |
f |
[GLC]A:1342 |
x,y,z |
1_555 |
2 |
1 |
293 |
4.3 |
0.2 |
0.246 |
0 |
0 |
0 |
0.000 |
55 |
|
[BGC]E:1343 |
3 |
1 |
303 |
f |
[GLC]E:1342 |
x,y,z |
1_555 |
2 |
1 |
291 |
3.6 |
0.2 |
0.241 |
0 |
0 |
0 |
0.000 |
56 |
|
[BGC]D:1343 |
3 |
1 |
303 |
f |
[GLC]D:1341 |
x,y,z |
1_555 |
2 |
1 |
292 |
2.0 |
0.1 |
0.199 |
0 |
0 |
0 |
0.000 |
Average: |
3.3 |
0.2 |
0.229 |
0 |
0 |
0 |
0.000 |
28 |
57 |
|
[BGC]C:1343 |
3 |
1 |
301 |
f |
[GLC]C:1342 |
x,y,z |
1_555 |
2 |
1 |
292 |
2.3 |
0.1 |
0.160 |
0 |
0 |
0 |
0.000 |
29 |
58 |
|
[GLC]A:1342 |
1 |
1 |
293 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
14151 |
0.9 |
0.0 |
0.350 |
0 |
0 |
0 |
0.000 |
|