## |
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 |
|
A |
34 |
6 |
8237 |
◊ |
C |
-x+1/2,y-1/2,-z |
4_545 |
31 |
6 |
8245 |
279.4 |
-11.0 |
0.548 |
2 |
0 |
0 |
0.035 |
2 |
2 |
|
B |
29 |
2 |
8367 |
◊ |
A |
-x,y,-z |
2_555 |
31 |
2 |
8237 |
209.9 |
6.5 |
0.997 |
0 |
0 |
0 |
0.000 |
3 |
|
D |
29 |
2 |
8431 |
◊ |
C |
-x+1/2,y-1/2,-z-1 |
4_544 |
31 |
2 |
8245 |
199.5 |
6.0 |
0.994 |
1 |
0 |
0 |
0.000 |
Average: |
204.7 |
6.2 |
0.995 |
1 |
0 |
0 |
0.000 |
3 |
4 |
|
B |
27 |
7 |
8367 |
◊ |
A |
x,y,z |
1_555 |
17 |
4 |
8237 |
170.0 |
-10.4 |
0.247 |
1 |
0 |
0 |
0.032 |
4 |
5 |
|
[GTP]C:1051 |
18 |
1 |
591 |
cf |
C |
x,y,z |
1_555 |
22 |
5 |
8245 |
165.1 |
-0.2 |
0.774 |
2 |
0 |
0 |
0.003 |
6 |
|
[GTP]B:1051 |
19 |
1 |
585 |
cf |
B |
x,y,z |
1_555 |
20 |
4 |
8367 |
155.8 |
0.6 |
0.852 |
2 |
0 |
0 |
0.003 |
Average: |
160.5 |
0.2 |
0.813 |
2 |
0 |
0 |
0.003 |
5 |
7 |
|
[GTP]A:1051 |
20 |
1 |
602 |
cf |
A |
x,y,z |
1_555 |
22 |
3 |
8237 |
161.2 |
1.2 |
0.872 |
2 |
0 |
0 |
0.000 |
8 |
|
[GTP]D:1051 |
17 |
1 |
600 |
cf |
D |
x,y,z |
1_555 |
21 |
4 |
8431 |
160.4 |
1.4 |
0.852 |
2 |
0 |
0 |
0.000 |
Average: |
160.8 |
1.3 |
0.862 |
2 |
0 |
0 |
0.000 |
6 |
9 |
|
[GTP]C:1051 |
14 |
1 |
591 |
◊ |
A |
x-1/2,y+1/2,z |
3_455 |
18 |
3 |
8237 |
133.3 |
-0.6 |
0.750 |
0 |
0 |
0 |
0.000 |
10 |
|
B |
16 |
4 |
8367 |
◊ |
[GTP]D:1051 |
x-1/2,y-1/2,z |
3_445 |
14 |
1 |
600 |
111.0 |
-1.5 |
0.691 |
0 |
0 |
0 |
0.000 |
11 |
|
[GTP]B:1051 |
13 |
1 |
585 |
◊ |
D |
x-1/2,y-1/2,z |
3_445 |
17 |
4 |
8431 |
95.6 |
-0.9 |
0.723 |
0 |
0 |
0 |
0.000 |
Average: |
113.3 |
-1.0 |
0.722 |
0 |
0 |
0 |
0.000 |
7 |
12 |
|
C |
17 |
5 |
8245 |
◊ |
A |
x,y,z |
1_555 |
17 |
5 |
8237 |
128.0 |
-5.4 |
0.555 |
0 |
0 |
0 |
0.002 |
8 |
13 |
|
B |
16 |
4 |
8367 |
◊ |
C |
x,y-1,z |
1_545 |
10 |
3 |
8245 |
122.3 |
-6.9 |
0.286 |
0 |
0 |
0 |
0.000 |
9 |
14 |
|
[K]B:1206 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
21 |
6 |
8367 |
114.4 |
-93.8 |
0.000 |
0 |
0 |
0 |
0.552 |
15 |
|
[K]A:1210 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
22 |
6 |
8237 |
111.8 |
-92.6 |
0.000 |
0 |
0 |
0 |
0.552 |
16 |
|
[K]C:1207 |
1 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
19 |
9 |
8245 |
108.0 |
-91.9 |
0.000 |
0 |
0 |
0 |
0.552 |
Average: |
111.4 |
-92.8 |
0.000 |
0 |
0 |
0 |
0.552 |
10 |
17 |
|
C |
17 |
3 |
8245 |
◊ |
[GTP]A:1051 |
x-1/2,y+1/2,z |
3_455 |
14 |
1 |
602 |
114.0 |
-1.0 |
0.731 |
0 |
0 |
0 |
0.000 |
11 |
18 |
|
[GTP]B:1051 |
15 |
1 |
585 |
◊ |
[GTP]D:1051 |
x-1/2,y-1/2,z |
3_445 |
15 |
1 |
600 |
109.8 |
1.9 |
0.804 |
0 |
0 |
0 |
0.000 |
19 |
|
[GTP]C:1051 |
17 |
1 |
591 |
◊ |
[GTP]A:1051 |
x-1/2,y+1/2,z |
3_455 |
15 |
1 |
602 |
101.8 |
1.9 |
0.786 |
0 |
0 |
0 |
0.000 |
Average: |
105.8 |
1.9 |
0.795 |
0 |
0 |
0 |
0.000 |
12 |
20 |
|
B |
12 |
3 |
8367 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
10 |
3 |
8237 |
88.9 |
-3.0 |
0.577 |
0 |
0 |
0 |
0.000 |
13 |
21 |
|
B |
7 |
2 |
8367 |
◊ |
C |
x-1/2,y-1/2,z |
3_445 |
10 |
2 |
8245 |
67.1 |
-2.4 |
0.496 |
0 |
0 |
0 |
0.000 |
14 |
22 |
|
[MG]A:1204 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
8237 |
59.1 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.055 |
23 |
|
[MG]C:1204 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
12 |
4 |
8245 |
56.4 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.055 |
Average: |
57.7 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.055 |
15 |
24 |
|
[MG]D:1201 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
13 |
7 |
8431 |
58.1 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.054 |
25 |
|
[MG]B:1201 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
8367 |
51.7 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.054 |
26 |
|
[MG]A:1201 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
8237 |
50.8 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.054 |
27 |
|
[MG]C:1201 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
9 |
4 |
8245 |
46.6 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.054 |
Average: |
51.8 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.054 |
16 |
28 |
|
[MG]B:1205 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
8367 |
56.8 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.025 |
17 |
29 |
|
[MG]A:1202 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
8237 |
54.7 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.049 |
30 |
|
[MG]B:1202 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
8367 |
44.9 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.049 |
31 |
|
[MG]C:1202 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
9 |
6 |
8245 |
41.3 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.049 |
Average: |
47.0 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.049 |
18 |
32 |
|
[MG]A:1203 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
8237 |
54.6 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.045 |
33 |
|
[MG]B:1203 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
8367 |
52.8 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.045 |
34 |
|
[MG]C:1203 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
5 |
8245 |
47.0 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.045 |
Average: |
51.5 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.045 |
19 |
35 |
|
[MG]D:1202 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
6 |
3 |
8431 |
50.4 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.049 |
20 |
36 |
|
[MG]A:1209 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
8237 |
49.0 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.042 |
21 |
37 |
|
[MG]C:1205 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
11 |
6 |
8245 |
47.2 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.021 |
22 |
38 |
|
[MG]A:1205 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
8237 |
40.3 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.034 |
23 |
39 |
|
[MG]A:1206 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
4 |
3 |
8237 |
40.3 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.037 |
24 |
40 |
|
[MG]C:1206 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
9 |
2 |
8245 |
40.2 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.016 |
25 |
41 |
|
[MG]A:1206 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
8245 |
38.3 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.002 |
26 |
42 |
|
[MG]B:1204 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
8367 |
38.2 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.026 |
43 |
|
[MG]A:1208 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
8237 |
30.0 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.026 |
Average: |
34.1 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.026 |
27 |
44 |
|
[MG]A:1207 |
1 |
1 |
98 |
x |
A |
x,y,z |
1_555 |
4 |
2 |
8237 |
32.3 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.026 |
28 |
45 |
|
[K]B:1206 |
1 |
1 |
216 |
f |
[MG]B:1202 |
x,y,z |
1_555 |
1 |
1 |
98 |
25.9 |
-14.6 |
0.000 |
0 |
0 |
0 |
0.043 |
29 |
46 |
|
[GTP]B:1051 |
1 |
1 |
585 |
◊ |
C |
x,y-1,z |
1_545 |
6 |
2 |
8245 |
25.5 |
-0.1 |
0.673 |
0 |
0 |
0 |
0.000 |
30 |
47 |
|
[K]C:1207 |
1 |
1 |
216 |
f |
[MG]C:1202 |
x,y,z |
1_555 |
1 |
1 |
98 |
24.9 |
-13.9 |
0.000 |
0 |
0 |
0 |
0.040 |
31 |
48 |
|
[K]A:1210 |
1 |
1 |
216 |
f |
[MG]A:1202 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.3 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.068 |
32 |
49 |
|
[MG]B:1205 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
8237 |
19.6 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.009 |
33 |
50 |
|
[K]A:1210 |
1 |
1 |
216 |
f |
[MG]A:1201 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.2 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.048 |
34 |
51 |
|
[K]C:1207 |
1 |
1 |
216 |
f |
[MG]C:1201 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.0 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.022 |
35 |
52 |
|
[MG]C:1206 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
8367 |
11.0 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.000 |
36 |
53 |
|
A |
1 |
1 |
8237 |
◊ |
A |
-x+1,y,-z |
2_655 |
1 |
1 |
8237 |
10.8 |
-1.2 |
0.179 |
0 |
0 |
0 |
0.003 |
37 |
54 |
|
[MG]A:1207 |
1 |
1 |
98 |
x |
[GTP]A:1051 |
x,y,z |
1_555 |
1 |
1 |
602 |
10.6 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.007 |
38 |
55 |
|
D |
3 |
1 |
8431 |
◊ |
B |
-x,y,-z-1 |
2_554 |
3 |
1 |
8367 |
9.6 |
-0.9 |
0.446 |
0 |
0 |
0 |
0.000 |
39 |
56 |
|
A |
2 |
1 |
8237 |
◊ |
A |
-x,y,-z |
2_555 |
2 |
1 |
8237 |
8.9 |
-0.4 |
0.390 |
0 |
0 |
0 |
0.000 |
40 |
57 |
|
[K]B:1206 |
1 |
1 |
216 |
f |
[MG]B:1201 |
x,y,z |
1_555 |
1 |
1 |
98 |
8.7 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.015 |
41 |
58 |
|
C |
1 |
1 |
8245 |
◊ |
[GTP]D:1051 |
x-1/2,y+1/2,z |
3_455 |
1 |
1 |
600 |
6.7 |
-0.7 |
0.217 |
0 |
0 |
0 |
0.000 |
42 |
59 |
|
C |
2 |
1 |
8245 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
8367 |
6.7 |
-0.2 |
0.378 |
0 |
0 |
0 |
0.000 |
43 |
60 |
|
D |
1 |
1 |
8431 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
8245 |
3.9 |
-0.4 |
0.233 |
0 |
0 |
0 |
0.000 |
|