## |
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 |
|
C |
138 |
41 |
14243 |
◊ |
A |
x,y,z |
1_555 |
144 |
41 |
14219 |
1380.7 |
-8.7 |
0.259 |
11 |
18 |
0 |
0.000 |
2 |
|
D |
139 |
40 |
14160 |
◊ |
B |
x,y,z |
1_555 |
136 |
41 |
14225 |
1379.8 |
-8.2 |
0.259 |
10 |
18 |
0 |
0.000 |
Average: |
1380.3 |
-8.5 |
0.259 |
11 |
18 |
0 |
0.000 |
2 |
3 |
|
C |
101 |
31 |
14243 |
◊ |
B |
x,y,z |
1_555 |
98 |
31 |
14225 |
910.5 |
1.4 |
0.741 |
7 |
2 |
0 |
0.000 |
4 |
|
D |
96 |
28 |
14160 |
◊ |
A |
x,y,z |
1_555 |
95 |
30 |
14219 |
867.7 |
1.3 |
0.728 |
8 |
3 |
0 |
0.000 |
Average: |
889.1 |
1.4 |
0.734 |
8 |
3 |
0 |
0.000 |
3 |
5 |
|
B |
66 |
19 |
14225 |
◊ |
A |
x,y,z |
1_555 |
66 |
19 |
14219 |
604.2 |
-7.1 |
0.156 |
4 |
5 |
0 |
0.000 |
6 |
|
D |
62 |
19 |
14160 |
◊ |
C |
x,y,z |
1_555 |
65 |
19 |
14243 |
591.2 |
-5.7 |
0.213 |
8 |
6 |
0 |
0.000 |
Average: |
597.7 |
-6.4 |
0.184 |
6 |
6 |
0 |
0.000 |
4 |
7 |
|
A |
43 |
14 |
14219 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
41 |
16 |
14225 |
369.4 |
-3.1 |
0.318 |
2 |
5 |
0 |
0.000 |
5 |
8 |
|
A |
32 |
11 |
14219 |
◊ |
B |
x-1,y,z |
1_455 |
31 |
9 |
14225 |
297.9 |
-0.7 |
0.352 |
1 |
2 |
0 |
0.000 |
6 |
9 |
|
C |
24 |
6 |
14243 |
x |
C |
x-1/2,-y+1/2,-z |
4_455 |
26 |
10 |
14243 |
213.2 |
-3.4 |
0.179 |
0 |
2 |
0 |
0.000 |
7 |
10 |
|
D |
17 |
5 |
14160 |
x |
D |
x-1/2,-y-1/2,-z |
4_445 |
18 |
8 |
14160 |
137.9 |
-0.9 |
0.450 |
0 |
0 |
0 |
0.000 |
8 |
11 |
|
B |
19 |
8 |
14225 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
16 |
9 |
14219 |
136.5 |
1.2 |
0.705 |
0 |
1 |
0 |
0.000 |
9 |
12 |
|
[PDO]A:406 |
5 |
1 |
212 |
f |
A |
x,y,z |
1_555 |
24 |
9 |
14219 |
134.8 |
3.6 |
0.226 |
1 |
0 |
0 |
0.000 |
10 |
13 |
|
[PDO]A:409 |
5 |
1 |
206 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
14219 |
133.6 |
3.5 |
0.353 |
0 |
0 |
0 |
0.000 |
11 |
14 |
|
[MLI]A:401 |
7 |
1 |
225 |
f |
A |
x,y,z |
1_555 |
20 |
12 |
14219 |
133.5 |
6.4 |
0.683 |
6 |
0 |
0 |
0.000 |
15 |
|
[MLI]B:401 |
7 |
1 |
223 |
f |
B |
x,y,z |
1_555 |
20 |
12 |
14225 |
133.2 |
6.4 |
0.682 |
6 |
0 |
0 |
0.000 |
16 |
|
[MLI]D:401 |
7 |
1 |
223 |
f |
D |
x,y,z |
1_555 |
20 |
12 |
14160 |
132.1 |
6.3 |
0.751 |
6 |
0 |
0 |
0.000 |
Average: |
132.9 |
6.4 |
0.705 |
6 |
0 |
0 |
0.000 |
12 |
17 |
|
[MLI]C:401 |
7 |
1 |
225 |
f |
C |
x,y,z |
1_555 |
20 |
12 |
14243 |
133.3 |
6.4 |
0.756 |
6 |
0 |
0 |
0.000 |
13 |
18 |
|
[PDO]B:409 |
5 |
1 |
211 |
◊ |
B |
x,y,z |
1_555 |
19 |
10 |
14225 |
132.7 |
4.2 |
0.392 |
1 |
0 |
0 |
0.000 |
14 |
19 |
|
[PDO]C:407 |
5 |
1 |
210 |
f |
C |
x,y,z |
1_555 |
22 |
9 |
14243 |
131.9 |
3.9 |
0.431 |
1 |
0 |
0 |
0.000 |
15 |
20 |
|
[PDO]A:403 |
5 |
1 |
210 |
◊ |
A |
x,y,z |
1_555 |
19 |
7 |
14219 |
129.1 |
4.5 |
0.279 |
1 |
0 |
0 |
0.000 |
21 |
|
[PDO]B:403 |
5 |
1 |
208 |
◊ |
B |
x,y,z |
1_555 |
20 |
7 |
14225 |
121.2 |
3.9 |
0.450 |
2 |
0 |
0 |
0.000 |
Average: |
125.2 |
4.2 |
0.364 |
2 |
0 |
0 |
0.000 |
16 |
22 |
|
[PDO]A:404 |
5 |
1 |
211 |
f |
A |
x,y,z |
1_555 |
23 |
10 |
14219 |
128.7 |
4.3 |
0.336 |
0 |
0 |
0 |
0.000 |
23 |
|
[PDO]B:405 |
5 |
1 |
211 |
f |
B |
x,y,z |
1_555 |
24 |
10 |
14225 |
121.0 |
3.9 |
0.332 |
0 |
0 |
0 |
0.000 |
Average: |
124.9 |
4.1 |
0.334 |
0 |
0 |
0 |
0.000 |
17 |
24 |
|
[PDO]A:407 |
5 |
1 |
210 |
f |
A |
x,y,z |
1_555 |
21 |
8 |
14219 |
127.6 |
4.1 |
0.484 |
0 |
0 |
0 |
0.000 |
18 |
25 |
|
[PDO]B:404 |
5 |
1 |
210 |
f |
B |
x,y,z |
1_555 |
22 |
9 |
14225 |
127.5 |
4.3 |
0.463 |
0 |
0 |
0 |
0.000 |
19 |
26 |
|
[PDO]C:405 |
5 |
1 |
212 |
f |
C |
x,y,z |
1_555 |
25 |
10 |
14243 |
125.8 |
4.7 |
0.433 |
1 |
0 |
0 |
0.000 |
20 |
27 |
|
[PDO]C:403 |
5 |
1 |
208 |
f |
C |
x,y,z |
1_555 |
21 |
8 |
14243 |
113.8 |
2.8 |
0.283 |
1 |
0 |
0 |
0.000 |
21 |
28 |
|
[PDO]C:406 |
5 |
1 |
210 |
f |
C |
x,y,z |
1_555 |
18 |
6 |
14243 |
111.0 |
3.4 |
0.080 |
0 |
0 |
0 |
0.000 |
22 |
29 |
|
[PDO]B:410 |
5 |
1 |
211 |
f |
B |
x,y,z |
1_555 |
16 |
6 |
14225 |
105.6 |
3.3 |
0.082 |
1 |
0 |
0 |
0.000 |
23 |
30 |
|
[PDO]A:405 |
5 |
1 |
207 |
f |
A |
x,y,z |
1_555 |
20 |
7 |
14219 |
101.0 |
3.5 |
0.357 |
0 |
0 |
0 |
0.000 |
24 |
31 |
|
[PDO]B:407 |
5 |
1 |
209 |
◊ |
C |
x,y,z |
1_555 |
17 |
5 |
14243 |
89.6 |
2.2 |
0.077 |
0 |
0 |
0 |
0.000 |
25 |
32 |
|
[PDO]C:404 |
5 |
1 |
207 |
◊ |
A |
x,y,z |
1_555 |
19 |
7 |
14219 |
88.4 |
1.8 |
0.162 |
0 |
0 |
0 |
0.000 |
26 |
33 |
|
[PDO]B:408 |
5 |
1 |
209 |
f |
D |
x,y,z |
1_555 |
16 |
6 |
14160 |
88.1 |
1.7 |
0.147 |
0 |
0 |
0 |
0.000 |
27 |
34 |
|
[PDO]B:408 |
5 |
1 |
209 |
◊ |
B |
x,y,z |
1_555 |
16 |
6 |
14225 |
87.5 |
1.7 |
0.153 |
0 |
0 |
0 |
0.000 |
28 |
35 |
|
[PDO]C:404 |
5 |
1 |
207 |
f |
C |
x,y,z |
1_555 |
14 |
6 |
14243 |
86.9 |
1.6 |
0.143 |
0 |
0 |
0 |
0.000 |
29 |
36 |
|
D |
10 |
2 |
14160 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
12 |
4 |
14219 |
84.0 |
-1.2 |
0.349 |
0 |
0 |
0 |
0.000 |
37 |
|
B |
7 |
4 |
14225 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
12 |
4 |
14243 |
77.8 |
-0.4 |
0.538 |
0 |
0 |
0 |
0.000 |
Average: |
80.9 |
-0.8 |
0.444 |
0 |
0 |
0 |
0.000 |
30 |
38 |
|
[PDO]B:411 |
5 |
1 |
209 |
◊ |
B |
x,y,z |
1_555 |
12 |
6 |
14225 |
82.6 |
1.2 |
0.546 |
0 |
0 |
0 |
0.000 |
31 |
39 |
|
[PDO]A:408 |
5 |
1 |
210 |
◊ |
A |
x,y,z |
1_555 |
13 |
6 |
14219 |
82.1 |
2.1 |
0.802 |
0 |
0 |
0 |
0.000 |
32 |
40 |
|
[PDO]A:412 |
5 |
1 |
211 |
◊ |
A |
x,y,z |
1_555 |
12 |
3 |
14219 |
80.7 |
2.3 |
0.870 |
0 |
0 |
0 |
0.000 |
33 |
41 |
|
[PDO]B:406 |
5 |
1 |
207 |
◊ |
B |
x,y,z |
1_555 |
12 |
3 |
14225 |
80.4 |
2.7 |
0.086 |
1 |
0 |
0 |
0.000 |
34 |
42 |
|
[PDO]A:411 |
5 |
1 |
211 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
14219 |
77.5 |
1.7 |
0.669 |
1 |
0 |
0 |
0.000 |
35 |
43 |
|
A |
7 |
2 |
14219 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
8 |
3 |
14219 |
76.9 |
0.4 |
0.643 |
0 |
0 |
0 |
0.000 |
36 |
44 |
|
[PDO]A:410 |
5 |
1 |
210 |
◊ |
A |
x,y,z |
1_555 |
15 |
6 |
14219 |
75.0 |
2.1 |
0.865 |
1 |
0 |
0 |
0.000 |
37 |
45 |
|
[PDO]B:407 |
5 |
1 |
209 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
14225 |
72.4 |
1.9 |
0.777 |
0 |
0 |
0 |
0.000 |
38 |
46 |
|
[PDO]A:411 |
5 |
1 |
211 |
◊ |
D |
x,y,z |
1_555 |
10 |
3 |
14160 |
69.7 |
2.0 |
0.794 |
1 |
0 |
0 |
0.000 |
39 |
47 |
|
[PDO]A:408 |
4 |
1 |
210 |
f |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
10 |
3 |
14225 |
61.8 |
1.8 |
0.114 |
0 |
0 |
0 |
0.000 |
40 |
48 |
|
[PDO]B:406 |
4 |
1 |
207 |
f |
D |
x,y,z |
1_555 |
7 |
3 |
14160 |
46.2 |
1.5 |
0.833 |
0 |
0 |
0 |
0.000 |
41 |
49 |
|
[PDO]B:411 |
4 |
1 |
209 |
f |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
5 |
1 |
14225 |
43.8 |
0.9 |
0.562 |
0 |
0 |
0 |
0.000 |
42 |
50 |
|
[CA]D:402 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
6 |
6 |
14160 |
42.9 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.215 |
51 |
|
[CA]B:402 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
5 |
5 |
14225 |
38.1 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.215 |
52 |
|
[CA]A:402 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
5 |
5 |
14219 |
37.3 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.215 |
53 |
|
[CA]C:402 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
5 |
5 |
14243 |
33.0 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.215 |
Average: |
37.8 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.215 |
43 |
54 |
|
[PDO]A:412 |
3 |
1 |
211 |
f |
C |
x,y,z |
1_555 |
7 |
3 |
14243 |
42.4 |
1.1 |
0.827 |
0 |
0 |
0 |
0.000 |
44 |
55 |
|
[PDO]A:411 |
3 |
1 |
211 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
14225 |
42.3 |
1.1 |
0.838 |
0 |
0 |
0 |
0.000 |
45 |
56 |
|
[PDO]B:409 |
3 |
1 |
211 |
◊ |
[PDO]B:405 |
x,y,z |
1_555 |
3 |
1 |
211 |
33.8 |
1.5 |
1.000 |
0 |
0 |
0 |
0.000 |
46 |
57 |
|
[PDO]C:405 |
3 |
1 |
212 |
f |
[CA]C:402 |
x,y,z |
1_555 |
1 |
1 |
85 |
19.9 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.000 |
47 |
58 |
|
C |
3 |
1 |
14243 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
2 |
14225 |
17.0 |
-0.3 |
0.449 |
0 |
0 |
0 |
0.000 |
48 |
59 |
|
B |
4 |
4 |
14225 |
x |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
3 |
2 |
14225 |
12.2 |
-0.2 |
0.499 |
0 |
0 |
0 |
0.000 |
49 |
60 |
|
[PDO]A:404 |
2 |
1 |
211 |
f |
[CA]A:402 |
x,y,z |
1_555 |
1 |
1 |
85 |
11.5 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
61 |
|
[PDO]B:405 |
2 |
1 |
211 |
f |
[CA]B:402 |
x,y,z |
1_555 |
1 |
1 |
85 |
9.7 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
10.6 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.000 |
50 |
62 |
|
B |
1 |
1 |
14225 |
f |
[PDO]A:403 |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
210 |
11.4 |
0.6 |
0.942 |
0 |
0 |
0 |
0.000 |
51 |
63 |
|
[PDO]B:405 |
1 |
1 |
211 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
14243 |
4.2 |
0.1 |
0.882 |
0 |
0 |
0 |
0.000 |
52 |
64 |
|
[PDO]A:410 |
1 |
1 |
210 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
14225 |
4.1 |
-0.0 |
0.588 |
0 |
0 |
0 |
0.000 |
53 |
65 |
|
[PDO]B:409 |
1 |
1 |
211 |
f |
C |
x,y,z |
1_555 |
1 |
1 |
14243 |
2.3 |
0.1 |
0.872 |
0 |
0 |
0 |
0.000 |
|