## |
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 |
531 |
129 |
23692 |
◊ |
A |
x,y,z |
1_555 |
529 |
128 |
23711 |
4889.8 |
-47.1 |
0.168 |
87 |
17 |
0 |
0.718 |
2 |
2 |
|
C |
268 |
64 |
13433 |
◊ |
B |
x,y,z |
1_555 |
287 |
77 |
17516 |
2613.0 |
-17.8 |
0.336 |
52 |
22 |
0 |
1.000 |
3 |
|
F |
269 |
64 |
13432 |
◊ |
E |
x,y,z |
1_555 |
286 |
78 |
17389 |
2598.0 |
-17.6 |
0.303 |
52 |
21 |
0 |
1.000 |
Average: |
2605.5 |
-17.7 |
0.319 |
52 |
22 |
0 |
1.000 |
3 |
4 |
|
C |
239 |
59 |
13433 |
◊ |
A |
x,y,z |
1_555 |
264 |
65 |
23711 |
2330.3 |
-19.1 |
0.232 |
34 |
11 |
0 |
0.717 |
5 |
|
F |
238 |
58 |
13432 |
◊ |
D |
x,y,z |
1_555 |
268 |
68 |
23692 |
2327.8 |
-20.2 |
0.179 |
33 |
13 |
0 |
0.717 |
Average: |
2329.1 |
-19.7 |
0.206 |
34 |
12 |
0 |
0.717 |
4 |
6 |
|
E |
218 |
53 |
17389 |
◊ |
A |
x,y,z |
1_555 |
267 |
82 |
23711 |
2181.5 |
-29.8 |
0.036 |
25 |
0 |
0 |
0.780 |
7 |
|
B |
220 |
53 |
17516 |
◊ |
D |
x,y,z |
1_555 |
270 |
80 |
23692 |
2173.5 |
-29.3 |
0.042 |
26 |
0 |
0 |
0.780 |
Average: |
2177.5 |
-29.6 |
0.039 |
26 |
0 |
0 |
0.780 |
5 |
8 |
|
E |
203 |
55 |
17389 |
◊ |
B |
x,y,z |
1_555 |
206 |
55 |
17516 |
1914.9 |
-17.2 |
0.266 |
24 |
2 |
0 |
1.000 |
6 |
9 |
|
E |
152 |
44 |
17389 |
◊ |
D |
x,y,z |
1_555 |
118 |
32 |
23692 |
1159.3 |
-11.5 |
0.272 |
10 |
9 |
0 |
0.574 |
10 |
|
B |
154 |
44 |
17516 |
◊ |
A |
x,y,z |
1_555 |
120 |
32 |
23711 |
1157.5 |
-11.5 |
0.279 |
9 |
9 |
0 |
0.574 |
Average: |
1158.4 |
-11.5 |
0.275 |
10 |
9 |
0 |
0.574 |
7 |
11 |
|
F |
72 |
22 |
13432 |
◊ |
A |
x,y,z |
1_555 |
63 |
18 |
23711 |
547.7 |
-2.4 |
0.576 |
11 |
4 |
0 |
0.075 |
12 |
|
C |
71 |
22 |
13433 |
◊ |
D |
x,y,z |
1_555 |
62 |
16 |
23692 |
544.5 |
-2.4 |
0.580 |
11 |
4 |
0 |
0.075 |
Average: |
546.1 |
-2.4 |
0.578 |
11 |
4 |
0 |
0.075 |
8 |
13 |
|
[F43]A:2570 |
38 |
1 |
1025 |
f |
D |
x,y,z |
1_555 |
49 |
17 |
23692 |
295.7 |
-3.5 |
0.410 |
7 |
0 |
0 |
0.220 |
14 |
|
[F43]D:5570 |
37 |
1 |
1023 |
f |
A |
x,y,z |
1_555 |
47 |
17 |
23711 |
294.1 |
-3.5 |
0.389 |
7 |
0 |
0 |
0.220 |
Average: |
294.9 |
-3.5 |
0.399 |
7 |
0 |
0 |
0.220 |
9 |
15 |
|
[F43]A:2570 |
40 |
1 |
1025 |
◊ |
A |
x,y,z |
1_555 |
42 |
16 |
23711 |
294.4 |
-3.6 |
0.332 |
4 |
0 |
0 |
0.087 |
16 |
|
[F43]D:5570 |
40 |
1 |
1023 |
◊ |
D |
x,y,z |
1_555 |
41 |
16 |
23692 |
292.9 |
-3.6 |
0.326 |
4 |
0 |
0 |
0.087 |
Average: |
293.6 |
-3.6 |
0.329 |
4 |
0 |
0 |
0.087 |
10 |
17 |
|
E |
28 |
12 |
17389 |
◊ |
D |
-x+3/2,-y+1,z-1/2 |
2_664 |
33 |
11 |
23692 |
289.4 |
1.3 |
0.811 |
5 |
1 |
0 |
0.000 |
18 |
|
B |
20 |
8 |
17516 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
30 |
9 |
23711 |
286.9 |
1.5 |
0.820 |
8 |
2 |
0 |
0.000 |
Average: |
288.2 |
1.4 |
0.815 |
7 |
2 |
0 |
0.000 |
11 |
19 |
|
F |
28 |
8 |
13432 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
29 |
9 |
13433 |
223.6 |
-1.7 |
0.469 |
4 |
0 |
0 |
0.000 |
12 |
20 |
|
[F43]A:2570 |
20 |
1 |
1025 |
◊ |
F |
x,y,z |
1_555 |
31 |
13 |
13432 |
189.4 |
0.4 |
0.744 |
8 |
0 |
0 |
0.062 |
21 |
|
[F43]D:5570 |
20 |
1 |
1023 |
◊ |
C |
x,y,z |
1_555 |
31 |
13 |
13433 |
189.2 |
0.4 |
0.748 |
8 |
0 |
0 |
0.062 |
Average: |
189.3 |
0.4 |
0.746 |
8 |
0 |
0 |
0.062 |
13 |
22 |
|
C |
12 |
4 |
13433 |
◊ |
E |
x,y,z |
1_555 |
17 |
7 |
17389 |
138.3 |
-2.0 |
0.220 |
0 |
0 |
0 |
0.034 |
23 |
|
F |
12 |
4 |
13432 |
◊ |
B |
x,y,z |
1_555 |
17 |
7 |
17516 |
137.2 |
-2.0 |
0.217 |
0 |
0 |
0 |
0.034 |
Average: |
137.8 |
-2.0 |
0.218 |
0 |
0 |
0 |
0.034 |
14 |
24 |
|
A |
18 |
6 |
23711 |
◊ |
F |
x-1/2,-y+1/2,-z+1 |
4_456 |
16 |
5 |
13432 |
132.1 |
0.3 |
0.691 |
1 |
0 |
0 |
0.000 |
25 |
|
C |
12 |
5 |
13433 |
◊ |
D |
x-1/2,-y+3/2,-z+1 |
4_466 |
8 |
3 |
23692 |
78.1 |
-0.0 |
0.637 |
1 |
0 |
0 |
0.000 |
Average: |
105.1 |
0.2 |
0.664 |
1 |
0 |
0 |
0.000 |
15 |
26 |
|
[GOL]A:2574 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
18 |
5 |
23711 |
120.5 |
0.1 |
0.635 |
3 |
0 |
0 |
0.041 |
16 |
27 |
|
[GOL]D:5573 |
6 |
1 |
221 |
f |
D |
x,y,z |
1_555 |
15 |
7 |
23692 |
99.6 |
0.4 |
0.669 |
5 |
0 |
0 |
0.061 |
28 |
|
[GOL]A:2573 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
23711 |
99.0 |
0.4 |
0.692 |
5 |
0 |
0 |
0.061 |
Average: |
99.3 |
0.4 |
0.681 |
5 |
0 |
0 |
0.061 |
17 |
29 |
|
[F43]D:5570 |
15 |
1 |
1023 |
◊ |
B |
x,y,z |
1_555 |
11 |
5 |
17516 |
92.2 |
0.1 |
0.531 |
2 |
0 |
0 |
0.028 |
30 |
|
[F43]A:2570 |
15 |
1 |
1025 |
◊ |
E |
x,y,z |
1_555 |
12 |
5 |
17389 |
91.7 |
0.1 |
0.548 |
2 |
0 |
0 |
0.028 |
Average: |
92.0 |
0.1 |
0.539 |
2 |
0 |
0 |
0.028 |
18 |
31 |
|
B |
8 |
2 |
17516 |
◊ |
E |
x-1,y,z |
1_455 |
10 |
5 |
17389 |
83.7 |
-1.3 |
0.313 |
0 |
0 |
0 |
0.000 |
19 |
32 |
|
[COM]D:5572 |
7 |
1 |
265 |
f |
[F43]A:2570 |
x,y,z |
1_555 |
19 |
1 |
1025 |
73.9 |
-1.4 |
0.386 |
0 |
0 |
0 |
0.046 |
33 |
|
[COM]A:2572 |
7 |
1 |
264 |
f |
[F43]D:5570 |
x,y,z |
1_555 |
20 |
1 |
1023 |
73.7 |
-1.3 |
0.431 |
0 |
0 |
0 |
0.046 |
Average: |
73.8 |
-1.3 |
0.408 |
0 |
0 |
0 |
0.046 |
20 |
34 |
|
[COM]D:5572 |
7 |
1 |
265 |
f |
D |
x,y,z |
1_555 |
15 |
5 |
23692 |
73.8 |
-1.0 |
0.373 |
1 |
0 |
0 |
0.049 |
35 |
|
[COM]A:2572 |
7 |
1 |
264 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
23711 |
73.5 |
-1.0 |
0.374 |
1 |
0 |
0 |
0.049 |
Average: |
73.6 |
-1.0 |
0.373 |
1 |
0 |
0 |
0.049 |
21 |
36 |
|
[GOL]A:2574 |
6 |
1 |
221 |
◊ |
E |
x,y,z |
1_555 |
7 |
3 |
17389 |
66.4 |
0.3 |
0.636 |
1 |
0 |
0 |
0.004 |
22 |
37 |
|
[COM]D:5572 |
6 |
1 |
265 |
◊ |
E |
x,y,z |
1_555 |
10 |
4 |
17389 |
53.5 |
-0.2 |
0.497 |
1 |
0 |
0 |
0.023 |
38 |
|
[COM]A:2572 |
6 |
1 |
264 |
◊ |
B |
x,y,z |
1_555 |
11 |
4 |
17516 |
53.2 |
-0.2 |
0.508 |
1 |
0 |
0 |
0.023 |
Average: |
53.4 |
-0.2 |
0.503 |
1 |
0 |
0 |
0.023 |
23 |
39 |
|
[GOL]D:5573 |
4 |
1 |
221 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
17516 |
52.3 |
-0.2 |
0.538 |
0 |
0 |
0 |
0.003 |
40 |
|
[GOL]A:2573 |
4 |
1 |
220 |
◊ |
E |
x,y,z |
1_555 |
5 |
2 |
17389 |
50.0 |
-0.1 |
0.546 |
0 |
0 |
0 |
0.003 |
Average: |
51.2 |
-0.1 |
0.542 |
0 |
0 |
0 |
0.003 |
24 |
41 |
|
B |
9 |
3 |
17516 |
◊ |
D |
-x+3/2,-y+1,z-1/2 |
2_664 |
4 |
3 |
23692 |
51.8 |
0.5 |
0.561 |
0 |
0 |
0 |
0.000 |
25 |
42 |
|
C |
4 |
2 |
13433 |
◊ |
E |
x-1,y,z |
1_455 |
4 |
1 |
17389 |
51.1 |
-0.8 |
0.291 |
0 |
0 |
0 |
0.000 |
26 |
43 |
|
[COM]A:2572 |
5 |
1 |
264 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
13433 |
32.4 |
0.5 |
0.645 |
1 |
0 |
0 |
0.000 |
44 |
|
[COM]D:5572 |
5 |
1 |
265 |
◊ |
F |
x,y,z |
1_555 |
4 |
2 |
13432 |
32.4 |
0.5 |
0.637 |
1 |
0 |
0 |
0.000 |
Average: |
32.4 |
0.5 |
0.641 |
1 |
0 |
0 |
0.000 |
27 |
45 |
|
E |
4 |
2 |
17389 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
5 |
3 |
23711 |
27.4 |
0.1 |
0.528 |
0 |
0 |
0 |
0.000 |
28 |
46 |
|
[COM]A:2572 |
4 |
1 |
264 |
◊ |
D |
x,y,z |
1_555 |
4 |
3 |
23692 |
16.0 |
-0.1 |
0.596 |
0 |
0 |
0 |
0.001 |
47 |
|
[COM]D:5572 |
3 |
1 |
265 |
◊ |
A |
x,y,z |
1_555 |
3 |
3 |
23711 |
16.0 |
-0.1 |
0.539 |
0 |
0 |
0 |
0.001 |
Average: |
16.0 |
-0.1 |
0.568 |
0 |
0 |
0 |
0.001 |
|