## |
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 |
331 |
88 |
23711 |
◊ |
B |
x,y,z |
1_555 |
329 |
89 |
24011 |
2949.1 |
-34.0 |
0.011 |
28 |
7 |
0 |
0.295 |
2 |
|
D |
325 |
89 |
23927 |
◊ |
A |
x,y,z |
1_555 |
330 |
87 |
23638 |
2906.0 |
-32.4 |
0.017 |
28 |
7 |
0 |
0.295 |
Average: |
2927.6 |
-33.2 |
0.014 |
28 |
7 |
0 |
0.295 |
2 |
3 |
|
D |
92 |
26 |
23927 |
x |
D |
-y+2,x+2,z |
3_775 |
100 |
29 |
23927 |
872.4 |
-3.7 |
0.517 |
8 |
2 |
0 |
0.000 |
4 |
|
B |
102 |
31 |
24011 |
x |
B |
-y+2,x+2,z |
3_775 |
96 |
26 |
24011 |
864.6 |
-4.2 |
0.498 |
9 |
2 |
0 |
0.000 |
Average: |
868.5 |
-4.0 |
0.508 |
9 |
2 |
0 |
0.000 |
3 |
5 |
|
D |
86 |
28 |
23927 |
◊ |
B |
x,y,z |
1_555 |
84 |
28 |
24011 |
790.4 |
-0.3 |
0.725 |
7 |
5 |
0 |
0.000 |
4 |
6 |
|
[FAD]E:703 |
52 |
1 |
990 |
f |
E |
x,y,z |
1_555 |
99 |
41 |
23711 |
671.7 |
-10.9 |
0.340 |
16 |
0 |
0 |
0.224 |
7 |
|
[FAD]D:703 |
52 |
1 |
987 |
f |
D |
x,y,z |
1_555 |
100 |
41 |
23927 |
669.8 |
-10.8 |
0.359 |
14 |
0 |
0 |
0.224 |
8 |
|
[FAD]A:703 |
52 |
1 |
986 |
f |
A |
x,y,z |
1_555 |
97 |
39 |
23638 |
667.1 |
-11.1 |
0.331 |
15 |
0 |
0 |
0.224 |
9 |
|
[FAD]B:703 |
53 |
1 |
966 |
f |
B |
x,y,z |
1_555 |
98 |
41 |
24011 |
660.5 |
-10.6 |
0.331 |
14 |
0 |
0 |
0.224 |
Average: |
667.3 |
-10.9 |
0.340 |
15 |
0 |
0 |
0.224 |
5 |
10 |
|
D |
59 |
15 |
23927 |
◊ |
B |
-y+5/2,-x+5/2,-z+1/2 |
16_775 |
68 |
17 |
24011 |
514.9 |
-3.9 |
0.399 |
2 |
2 |
0 |
0.000 |
6 |
11 |
|
[AUJ]A:705 |
27 |
1 |
660 |
f |
A |
x,y,z |
1_555 |
47 |
21 |
23638 |
285.0 |
-3.2 |
0.180 |
16 |
0 |
0 |
0.066 |
7 |
12 |
|
[PXD]D:702 |
28 |
1 |
618 |
◊ |
A |
x,y,z |
1_555 |
38 |
14 |
23638 |
269.6 |
-2.6 |
0.374 |
2 |
0 |
0 |
0.043 |
13 |
|
[PXD]B:702 |
27 |
1 |
623 |
◊ |
E |
x,y,z |
1_555 |
38 |
14 |
23711 |
268.7 |
-2.5 |
0.344 |
2 |
0 |
0 |
0.043 |
14 |
|
[PXD]E:702 |
27 |
1 |
625 |
◊ |
B |
x,y,z |
1_555 |
34 |
13 |
24011 |
264.6 |
-2.6 |
0.319 |
2 |
0 |
0 |
0.043 |
15 |
|
[PXD]A:702 |
27 |
1 |
626 |
◊ |
D |
x,y,z |
1_555 |
35 |
13 |
23927 |
241.7 |
-2.1 |
0.390 |
2 |
0 |
0 |
0.043 |
Average: |
261.2 |
-2.5 |
0.357 |
2 |
0 |
0 |
0.043 |
8 |
16 |
|
[TP9]E:704 |
25 |
1 |
580 |
f |
E |
x,y,z |
1_555 |
46 |
21 |
23711 |
268.3 |
-9.5 |
0.232 |
12 |
0 |
0 |
0.189 |
17 |
|
[TP9]B:704 |
25 |
1 |
578 |
f |
B |
x,y,z |
1_555 |
44 |
21 |
24011 |
266.3 |
-9.3 |
0.234 |
14 |
0 |
0 |
0.189 |
18 |
|
[TP9]D:704 |
24 |
1 |
577 |
f |
D |
x,y,z |
1_555 |
45 |
21 |
23927 |
266.1 |
-9.2 |
0.220 |
17 |
0 |
0 |
0.189 |
Average: |
266.9 |
-9.4 |
0.229 |
14 |
0 |
0 |
0.189 |
9 |
19 |
|
[PXD]E:702 |
27 |
1 |
625 |
f |
E |
x,y,z |
1_555 |
31 |
8 |
23711 |
209.7 |
-3.2 |
0.332 |
5 |
0 |
0 |
0.070 |
20 |
|
[PXD]A:702 |
28 |
1 |
626 |
f |
A |
x,y,z |
1_555 |
32 |
8 |
23638 |
209.4 |
-3.1 |
0.356 |
5 |
0 |
0 |
0.070 |
21 |
|
[PXD]B:702 |
29 |
1 |
623 |
f |
B |
x,y,z |
1_555 |
29 |
8 |
24011 |
206.7 |
-2.9 |
0.353 |
6 |
0 |
0 |
0.070 |
22 |
|
[PXD]D:702 |
29 |
1 |
618 |
f |
D |
x,y,z |
1_555 |
31 |
8 |
23927 |
204.3 |
-2.8 |
0.388 |
6 |
0 |
0 |
0.070 |
Average: |
207.5 |
-3.0 |
0.357 |
6 |
0 |
0 |
0.070 |
10 |
23 |
|
A |
24 |
9 |
23638 |
◊ |
A |
-x,y,-z |
5_555 |
24 |
9 |
23638 |
202.8 |
-3.6 |
0.188 |
0 |
0 |
0 |
0.000 |
11 |
24 |
|
A |
20 |
6 |
23638 |
◊ |
D |
-y+2,x+2,z |
3_775 |
23 |
9 |
23927 |
182.4 |
0.4 |
0.693 |
2 |
0 |
0 |
0.000 |
25 |
|
B |
21 |
9 |
24011 |
◊ |
E |
-y+2,x+2,z |
3_775 |
19 |
7 |
23711 |
154.4 |
0.8 |
0.742 |
1 |
0 |
0 |
0.000 |
Average: |
168.4 |
0.6 |
0.717 |
2 |
0 |
0 |
0.000 |
12 |
26 |
|
A |
24 |
12 |
23638 |
x |
A |
-y+2,x+2,z |
3_775 |
23 |
14 |
23638 |
182.1 |
-1.0 |
0.443 |
2 |
0 |
0 |
0.000 |
27 |
|
E |
23 |
13 |
23711 |
x |
E |
-y+2,x+2,z |
3_775 |
22 |
9 |
23711 |
178.3 |
0.2 |
0.595 |
1 |
0 |
0 |
0.000 |
Average: |
180.2 |
-0.4 |
0.519 |
2 |
0 |
0 |
0.000 |
13 |
28 |
|
[AUJ]A:705 |
16 |
1 |
660 |
◊ |
D |
x,y,z |
1_555 |
24 |
11 |
23927 |
167.1 |
-0.3 |
0.489 |
4 |
0 |
0 |
0.013 |
14 |
29 |
|
[TP9]D:704 |
14 |
1 |
577 |
◊ |
A |
x,y,z |
1_555 |
24 |
10 |
23638 |
157.2 |
-0.0 |
0.621 |
2 |
0 |
0 |
0.010 |
30 |
|
[TP9]E:704 |
14 |
1 |
580 |
◊ |
B |
x,y,z |
1_555 |
23 |
10 |
24011 |
154.2 |
0.1 |
0.634 |
2 |
0 |
0 |
0.010 |
31 |
|
[TP9]B:704 |
14 |
1 |
578 |
◊ |
E |
x,y,z |
1_555 |
23 |
10 |
23711 |
153.8 |
0.0 |
0.634 |
2 |
0 |
0 |
0.010 |
Average: |
155.1 |
0.0 |
0.630 |
2 |
0 |
0 |
0.010 |
15 |
32 |
|
[FAD]D:703 |
9 |
1 |
987 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
23638 |
60.2 |
-2.1 |
0.219 |
0 |
0 |
0 |
0.026 |
33 |
|
[FAD]E:703 |
9 |
1 |
990 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
24011 |
57.2 |
-2.1 |
0.289 |
0 |
0 |
0 |
0.026 |
34 |
|
[FAD]B:703 |
7 |
1 |
966 |
◊ |
E |
x,y,z |
1_555 |
8 |
3 |
23711 |
56.6 |
-2.0 |
0.201 |
0 |
0 |
0 |
0.026 |
35 |
|
[FAD]A:703 |
9 |
1 |
986 |
◊ |
D |
x,y,z |
1_555 |
6 |
2 |
23927 |
44.3 |
-1.7 |
0.225 |
0 |
0 |
0 |
0.026 |
Average: |
54.6 |
-2.0 |
0.234 |
0 |
0 |
0 |
0.026 |
16 |
36 |
|
[AUJ]A:705 |
5 |
1 |
660 |
f |
[PXD]A:702 |
x,y,z |
1_555 |
10 |
1 |
626 |
55.0 |
-0.8 |
0.390 |
0 |
0 |
0 |
0.005 |
17 |
37 |
|
[FAD]D:703 |
9 |
1 |
987 |
f |
[PXD]D:702 |
x,y,z |
1_555 |
3 |
1 |
618 |
41.0 |
-0.4 |
0.418 |
0 |
0 |
0 |
0.006 |
38 |
|
[FAD]E:703 |
9 |
1 |
990 |
f |
[PXD]E:702 |
x,y,z |
1_555 |
3 |
1 |
625 |
40.8 |
-0.5 |
0.413 |
0 |
0 |
0 |
0.006 |
39 |
|
[FAD]A:703 |
9 |
1 |
986 |
f |
[PXD]A:702 |
x,y,z |
1_555 |
3 |
1 |
626 |
40.0 |
-0.4 |
0.428 |
0 |
0 |
0 |
0.006 |
40 |
|
[FAD]B:703 |
9 |
1 |
966 |
f |
[PXD]B:702 |
x,y,z |
1_555 |
3 |
1 |
623 |
39.6 |
-0.4 |
0.405 |
0 |
0 |
0 |
0.006 |
Average: |
40.4 |
-0.4 |
0.416 |
0 |
0 |
0 |
0.006 |
18 |
41 |
|
[MG]B:701 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
9 |
24011 |
37.6 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.080 |
42 |
|
[MG]D:701 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
11 |
9 |
23927 |
37.3 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.080 |
43 |
|
[MG]E:701 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
12 |
9 |
23711 |
37.3 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.080 |
44 |
|
[MG]A:701 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
9 |
23638 |
37.2 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.080 |
Average: |
37.4 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.080 |
19 |
45 |
|
[TP9]B:704 |
5 |
1 |
578 |
f |
[MG]B:701 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.9 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.060 |
46 |
|
[TP9]E:704 |
4 |
1 |
580 |
f |
[MG]E:701 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.060 |
47 |
|
[TP9]D:704 |
4 |
1 |
577 |
f |
[MG]D:701 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.5 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.060 |
Average: |
29.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.060 |
20 |
48 |
|
[AUJ]A:705 |
4 |
1 |
660 |
f |
[MG]A:701 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.5 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.021 |
21 |
49 |
|
[AUJ]A:705 |
2 |
1 |
660 |
f |
[FAD]A:703 |
x,y,z |
1_555 |
2 |
1 |
986 |
24.7 |
-0.7 |
0.317 |
0 |
0 |
0 |
0.004 |
22 |
50 |
|
[TP9]B:704 |
3 |
1 |
578 |
f |
[PXD]B:702 |
x,y,z |
1_555 |
2 |
1 |
623 |
15.6 |
-0.5 |
0.445 |
0 |
0 |
0 |
0.006 |
51 |
|
[TP9]D:704 |
3 |
1 |
577 |
f |
[PXD]D:702 |
x,y,z |
1_555 |
2 |
1 |
618 |
14.5 |
-0.5 |
0.455 |
0 |
0 |
0 |
0.006 |
52 |
|
[TP9]E:704 |
3 |
1 |
580 |
f |
[PXD]E:702 |
x,y,z |
1_555 |
2 |
1 |
625 |
13.3 |
-0.4 |
0.468 |
0 |
0 |
0 |
0.006 |
Average: |
14.5 |
-0.5 |
0.456 |
0 |
0 |
0 |
0.006 |
23 |
53 |
|
[TP9]E:704 |
1 |
1 |
580 |
f |
[FAD]E:703 |
x,y,z |
1_555 |
1 |
1 |
990 |
5.8 |
-0.3 |
0.390 |
0 |
0 |
0 |
0.003 |
54 |
|
[TP9]D:704 |
1 |
1 |
577 |
f |
[FAD]D:703 |
x,y,z |
1_555 |
1 |
1 |
987 |
4.0 |
-0.2 |
0.390 |
0 |
0 |
0 |
0.003 |
55 |
|
[TP9]B:704 |
1 |
1 |
578 |
f |
[FAD]B:703 |
x,y,z |
1_555 |
1 |
1 |
966 |
2.7 |
-0.1 |
0.387 |
0 |
0 |
0 |
0.003 |
Average: |
4.2 |
-0.2 |
0.389 |
0 |
0 |
0 |
0.003 |
|