| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
A |
57 |
16 |
17223 |
x |
A |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
72 |
25 |
17223 |
577.2 |
1.7 |
0.673 |
7 |
8 |
0 |
0.000 |
2 |
|
A |
55 |
16 |
17223 |
x |
A |
x-1/2,-y-1/2,-z |
8_445 |
52 |
17 |
17223 |
489.6 |
1.1 |
0.739 |
4 |
2 |
0 |
0.000 |
3 |
|
A |
39 |
11 |
17223 |
◊ |
A |
-x-1,y,-z+1/2 |
3_455 |
38 |
11 |
17223 |
361.8 |
-9.2 |
0.013 |
4 |
0 |
0 |
0.000 |
4 |
|
A |
28 |
12 |
17223 |
◊ |
A |
x,-y-1,-z |
4_545 |
28 |
12 |
17223 |
299.8 |
9.5 |
0.996 |
6 |
14 |
0 |
0.000 |
5 |
|
[MPD]A:1465 |
7 |
1 |
278 |
f |
A |
x,y,z |
1_555 |
22 |
12 |
17223 |
166.5 |
-11.9 |
0.639 |
5 |
0 |
0 |
0.110 |
6 |
|
[MPD]A:1471 |
7 |
1 |
268 |
f |
A |
x,y,z |
1_555 |
26 |
10 |
17223 |
158.0 |
-7.9 |
0.867 |
1 |
0 |
0 |
0.066 |
7 |
|
[MRD]A:1467 |
7 |
1 |
273 |
f |
A |
x,y,z |
1_555 |
24 |
8 |
17223 |
156.6 |
2.3 |
0.336 |
1 |
0 |
0 |
0.000 |
8 |
|
[MPD]A:1476 |
7 |
1 |
273 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
17223 |
151.5 |
-8.7 |
0.751 |
1 |
0 |
0 |
0.071 |
9 |
|
[MRD]A:1466 |
6 |
1 |
273 |
◊ |
A |
x,y,z |
1_555 |
20 |
8 |
17223 |
151.4 |
2.6 |
0.467 |
0 |
0 |
0 |
0.000 |
10 |
|
A |
16 |
6 |
17223 |
◊ |
A |
x,-y,-z |
4_555 |
16 |
6 |
17223 |
143.1 |
-2.3 |
0.239 |
0 |
0 |
0 |
0.000 |
11 |
|
[MPD]A:1470 |
7 |
1 |
276 |
f |
A |
x,y,z |
1_555 |
19 |
10 |
17223 |
141.2 |
-9.7 |
0.506 |
1 |
0 |
0 |
0.079 |
12 |
|
[MRD]A:1474 |
7 |
1 |
277 |
◊ |
A |
x,y,z |
1_555 |
23 |
12 |
17223 |
137.2 |
1.5 |
0.392 |
4 |
0 |
0 |
0.000 |
13 |
|
A |
16 |
6 |
17223 |
f |
[MPD]A:1475 |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
5 |
1 |
267 |
130.0 |
-7.6 |
0.656 |
1 |
0 |
0 |
0.063 |
14 |
|
[MPD]A:1477 |
7 |
1 |
275 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
17223 |
126.0 |
-7.2 |
0.758 |
1 |
0 |
0 |
0.059 |
15 |
|
[MRD]A:1480 |
8 |
1 |
272 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
17223 |
124.7 |
1.3 |
0.281 |
0 |
0 |
0 |
0.000 |
16 |
|
A |
15 |
4 |
17223 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
15 |
4 |
17223 |
119.9 |
-1.3 |
0.401 |
2 |
0 |
0 |
0.008 |
17 |
|
[MPD]A:1472 |
7 |
1 |
268 |
◊ |
A |
x,-y-1,-z |
4_545 |
16 |
5 |
17223 |
111.3 |
-5.0 |
0.912 |
0 |
0 |
0 |
0.000 |
18 |
|
[MPD]A:1469 |
7 |
1 |
279 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
17223 |
110.7 |
-6.0 |
0.884 |
1 |
0 |
0 |
0.050 |
19 |
|
A |
16 |
4 |
17223 |
f |
[MRD]A:1468 |
x-1/2,-y-1/2,-z |
8_445 |
6 |
1 |
264 |
100.0 |
1.4 |
0.383 |
1 |
0 |
0 |
0.000 |
20 |
|
[MRD]A:1468 |
6 |
1 |
264 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
17223 |
97.0 |
1.6 |
0.375 |
1 |
0 |
0 |
0.000 |
21 |
|
[MPD]A:1473 |
8 |
1 |
269 |
f |
[MPD]A:1473 |
-x,y,-z+1/2 |
3_555 |
8 |
1 |
269 |
94.9 |
-9.1 |
0.996 |
0 |
0 |
0 |
0.100 |
22 |
|
[MPD]A:1472 |
6 |
1 |
268 |
f |
A |
x,y,z |
1_555 |
17 |
5 |
17223 |
93.7 |
-5.6 |
0.676 |
0 |
0 |
0 |
0.044 |
23 |
|
[MPD]A:1478 |
5 |
1 |
273 |
f |
A |
x-1/2,-y-1/2,-z |
8_445 |
9 |
5 |
17223 |
86.7 |
-4.6 |
0.815 |
1 |
0 |
0 |
0.039 |
24 |
|
[MPD]A:1473 |
8 |
1 |
269 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
17 |
6 |
17223 |
84.2 |
-4.3 |
0.763 |
3 |
0 |
0 |
0.044 |
25 |
|
[MRD]A:1479 |
5 |
1 |
262 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
17223 |
84.1 |
1.3 |
0.427 |
0 |
0 |
0 |
0.000 |
26 |
|
[MPD]A:1473 |
7 |
1 |
269 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
17223 |
82.0 |
-4.4 |
0.766 |
3 |
0 |
0 |
0.044 |
27 |
|
[MPD]A:1475 |
6 |
1 |
267 |
◊ |
A |
x,y,z |
1_555 |
11 |
3 |
17223 |
76.7 |
-4.2 |
0.000 |
1 |
0 |
0 |
0.000 |
28 |
|
[MRD]A:1479 |
7 |
1 |
262 |
◊ |
A |
x,-y-1,-z |
4_545 |
11 |
3 |
17223 |
75.8 |
0.5 |
0.284 |
0 |
0 |
0 |
0.000 |
29 |
|
A |
10 |
3 |
17223 |
f |
[MRD]A:1466 |
x-1/2,-y-1/2,-z |
8_445 |
5 |
1 |
273 |
63.0 |
0.1 |
0.325 |
0 |
0 |
0 |
0.000 |
30 |
|
[MPD]A:1478 |
4 |
1 |
273 |
◊ |
A |
x,y,z |
1_555 |
11 |
6 |
17223 |
60.7 |
-3.7 |
0.000 |
1 |
0 |
0 |
0.000 |
31 |
|
[CU]A:1462 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
2 |
2 |
17223 |
47.5 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.074 |
32 |
|
[CU]A:1464 |
1 |
1 |
125 |
cf |
A |
x,y,z |
1_555 |
2 |
2 |
17223 |
47.2 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.074 |
33 |
|
[MPD]A:1470 |
4 |
1 |
276 |
f |
[MPD]A:1465 |
x,y,z |
1_555 |
3 |
1 |
278 |
41.2 |
-4.0 |
0.000 |
1 |
0 |
0 |
0.034 |
34 |
|
[MRD]A:1479 |
3 |
1 |
262 |
f |
[MPD]A:1472 |
x,y,z |
1_555 |
3 |
1 |
268 |
37.4 |
-1.6 |
0.518 |
0 |
0 |
0 |
0.012 |
35 |
|
[MRD]A:1467 |
3 |
1 |
273 |
f |
[MPD]A:1477 |
x,y,z |
1_555 |
5 |
1 |
275 |
36.1 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.005 |
36 |
|
[MRD]A:1480 |
3 |
1 |
272 |
f |
[MPD]A:1469 |
x,y,z |
1_555 |
3 |
1 |
279 |
33.8 |
-0.9 |
0.568 |
0 |
0 |
0 |
0.007 |
37 |
|
[MRD]A:1474 |
2 |
1 |
277 |
f |
[MPD]A:1478 |
x,y,z |
1_555 |
3 |
1 |
273 |
32.5 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.016 |
38 |
|
[OH]A:1481 |
1 |
1 |
99 |
f |
A |
x,y,z |
1_555 |
6 |
6 |
17223 |
31.8 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.026 |
39 |
|
[MPD]A:1477 |
2 |
1 |
275 |
f |
[MPD]A:1469 |
x,y,z |
1_555 |
4 |
1 |
279 |
28.6 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.021 |
40 |
|
[OH]A:1481 |
1 |
1 |
99 |
f |
[CU]A:1464 |
x,y,z |
1_555 |
1 |
1 |
125 |
20.2 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.024 |
41 |
|
[OH]A:1481 |
1 |
1 |
99 |
f |
[CU]A:1462 |
x,y,z |
1_555 |
1 |
1 |
125 |
19.1 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.023 |
42 |
|
[CU]A:1464 |
1 |
1 |
125 |
f |
[CU]A:1462 |
x,y,z |
1_555 |
1 |
1 |
125 |
9.8 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.015 |
43 |
|
[MPD]A:1478 |
1 |
1 |
273 |
◊ |
A |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
1 |
1 |
17223 |
9.1 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
44 |
|
[MRD]A:1467 |
1 |
1 |
273 |
◊ |
A |
-x-1,y,-z+1/2 |
3_455 |
1 |
1 |
17223 |
7.8 |
0.0 |
0.493 |
0 |
0 |
0 |
0.000 |
45 |
|
[MRD]A:1474 |
1 |
1 |
277 |
◊ |
A |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
2 |
1 |
17223 |
7.2 |
0.4 |
0.672 |
0 |
0 |
0 |
0.000 |
|