## |
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 |
468 |
116 |
24142 |
◊ |
C |
x,y,z |
1_555 |
471 |
129 |
19949 |
4437.0 |
-55.3 |
0.011 |
32 |
17 |
0 |
0.533 |
2 |
|
B |
462 |
116 |
24240 |
◊ |
A |
x,y,z |
1_555 |
459 |
127 |
19670 |
4386.7 |
-59.2 |
0.003 |
31 |
14 |
0 |
0.533 |
Average: |
4411.9 |
-57.3 |
0.007 |
32 |
16 |
0 |
0.533 |
2 |
3 |
|
D |
312 |
78 |
24142 |
◊ |
B |
x,y,z |
1_555 |
312 |
79 |
24240 |
2898.5 |
-20.7 |
0.413 |
31 |
28 |
0 |
0.656 |
3 |
4 |
|
B |
141 |
36 |
24240 |
◊ |
C |
x,y,z |
1_555 |
151 |
38 |
19949 |
1288.6 |
-17.2 |
0.114 |
8 |
6 |
0 |
0.313 |
5 |
|
D |
142 |
36 |
24142 |
◊ |
A |
x,y,z |
1_555 |
148 |
39 |
19670 |
1277.2 |
-17.5 |
0.117 |
6 |
6 |
0 |
0.313 |
Average: |
1282.9 |
-17.3 |
0.116 |
7 |
6 |
0 |
0.313 |
4 |
6 |
|
D |
40 |
18 |
24142 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
47 |
22 |
19949 |
367.4 |
0.7 |
0.788 |
3 |
3 |
0 |
0.000 |
7 |
|
A |
46 |
21 |
19670 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
36 |
13 |
24240 |
360.8 |
1.5 |
0.832 |
0 |
3 |
0 |
0.000 |
Average: |
364.1 |
1.1 |
0.810 |
2 |
3 |
0 |
0.000 |
5 |
8 |
|
[ICS]C:502 |
17 |
1 |
485 |
f |
C |
x,y,z |
1_555 |
48 |
18 |
19949 |
312.9 |
-19.4 |
0.718 |
1 |
0 |
0 |
0.287 |
9 |
|
[ICS]A:502 |
17 |
1 |
484 |
f |
A |
x,y,z |
1_555 |
47 |
18 |
19670 |
312.3 |
-19.3 |
0.728 |
0 |
0 |
0 |
0.287 |
Average: |
312.6 |
-19.3 |
0.723 |
1 |
0 |
0 |
0.287 |
6 |
10 |
|
D |
23 |
6 |
24142 |
◊ |
A |
x,y,z-1 |
1_554 |
26 |
8 |
19670 |
238.9 |
-1.2 |
0.441 |
0 |
2 |
0 |
0.000 |
11 |
|
C |
28 |
9 |
19949 |
◊ |
B |
x,y,z-1 |
1_554 |
29 |
8 |
24240 |
233.4 |
-0.6 |
0.619 |
1 |
2 |
0 |
0.000 |
Average: |
236.2 |
-0.9 |
0.530 |
1 |
2 |
0 |
0.000 |
7 |
12 |
|
A |
26 |
7 |
19670 |
x |
A |
-x,y-1/2,-z+1 |
2_546 |
21 |
5 |
19670 |
227.1 |
-1.8 |
0.193 |
0 |
0 |
0 |
0.000 |
13 |
|
C |
21 |
5 |
19949 |
x |
C |
-x,y-1/2,-z |
2_545 |
26 |
8 |
19949 |
202.6 |
-2.1 |
0.361 |
0 |
0 |
0 |
0.000 |
Average: |
214.9 |
-1.9 |
0.277 |
0 |
0 |
0 |
0.000 |
8 |
14 |
|
C |
26 |
8 |
19949 |
◊ |
A |
x,y,z-1 |
1_554 |
26 |
6 |
19670 |
209.9 |
-0.5 |
0.633 |
0 |
2 |
0 |
0.000 |
9 |
15 |
|
C |
23 |
7 |
19949 |
◊ |
B |
x-1,y,z-1 |
1_454 |
21 |
8 |
24240 |
205.9 |
-0.3 |
0.652 |
0 |
1 |
0 |
0.000 |
10 |
16 |
|
[HCA]C:501 |
13 |
1 |
342 |
f |
C |
x,y,z |
1_555 |
35 |
17 |
19949 |
203.2 |
0.7 |
0.433 |
4 |
0 |
0 |
0.018 |
17 |
|
[HCA]A:501 |
13 |
1 |
341 |
f |
A |
x,y,z |
1_555 |
36 |
17 |
19670 |
198.1 |
0.6 |
0.437 |
4 |
0 |
0 |
0.018 |
Average: |
200.6 |
0.6 |
0.435 |
4 |
0 |
0 |
0.018 |
11 |
18 |
|
A |
22 |
6 |
19670 |
◊ |
B |
x-1,y,z |
1_455 |
24 |
10 |
24240 |
191.7 |
-1.7 |
0.471 |
0 |
0 |
0 |
0.000 |
12 |
19 |
|
[CLF]B:601 |
12 |
1 |
453 |
f |
A |
x,y,z |
1_555 |
27 |
10 |
19670 |
182.0 |
-18.3 |
0.080 |
0 |
0 |
0 |
0.273 |
20 |
|
[CLF]D:601 |
12 |
1 |
453 |
f |
C |
x,y,z |
1_555 |
27 |
10 |
19949 |
180.6 |
-18.3 |
0.078 |
0 |
0 |
0 |
0.273 |
Average: |
181.3 |
-18.3 |
0.079 |
0 |
0 |
0 |
0.273 |
13 |
21 |
|
[CLF]D:601 |
12 |
1 |
453 |
◊ |
D |
x,y,z |
1_555 |
23 |
11 |
24142 |
180.5 |
-17.6 |
0.094 |
0 |
0 |
0 |
0.126 |
22 |
|
[CLF]B:601 |
12 |
1 |
453 |
◊ |
B |
x,y,z |
1_555 |
23 |
11 |
24240 |
179.0 |
-17.4 |
0.094 |
0 |
0 |
0 |
0.126 |
Average: |
179.8 |
-17.5 |
0.094 |
0 |
0 |
0 |
0.126 |
14 |
23 |
|
B |
14 |
4 |
24240 |
◊ |
D |
x-1,y,z |
1_455 |
16 |
6 |
24142 |
146.7 |
0.0 |
0.616 |
2 |
0 |
0 |
0.000 |
15 |
24 |
|
[ICS]A:502 |
7 |
1 |
484 |
f |
[HCA]A:501 |
x,y,z |
1_555 |
7 |
1 |
341 |
66.1 |
-1.9 |
0.664 |
0 |
0 |
0 |
0.051 |
25 |
|
[ICS]C:502 |
7 |
1 |
485 |
f |
[HCA]C:501 |
x,y,z |
1_555 |
7 |
1 |
342 |
65.9 |
-3.6 |
0.413 |
0 |
0 |
0 |
0.051 |
Average: |
66.0 |
-2.7 |
0.539 |
0 |
0 |
0 |
0.051 |
16 |
26 |
|
[FE]D:602 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
24240 |
46.2 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.183 |
27 |
|
[FE]B:602 |
1 |
1 |
137 |
f |
D |
x,y,z |
1_555 |
11 |
5 |
24142 |
45.7 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.183 |
Average: |
46.0 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.183 |
17 |
28 |
|
D |
6 |
2 |
24142 |
x |
D |
x-1,y,z |
1_455 |
6 |
2 |
24142 |
45.9 |
-0.2 |
0.571 |
0 |
0 |
0 |
0.000 |
18 |
29 |
|
[HCA]A:501 |
7 |
1 |
341 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
24240 |
45.2 |
1.0 |
0.498 |
0 |
0 |
0 |
0.000 |
30 |
|
[HCA]C:501 |
7 |
1 |
342 |
◊ |
D |
x,y,z |
1_555 |
6 |
3 |
24142 |
44.8 |
1.3 |
0.549 |
0 |
0 |
0 |
0.000 |
Average: |
45.0 |
1.1 |
0.524 |
0 |
0 |
0 |
0.000 |
19 |
31 |
|
[FE]B:602 |
1 |
1 |
137 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
24240 |
40.5 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.161 |
32 |
|
[FE]D:602 |
1 |
1 |
137 |
◊ |
D |
x,y,z |
1_555 |
7 |
3 |
24142 |
39.9 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.161 |
Average: |
40.2 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.161 |
20 |
33 |
|
A |
8 |
5 |
19670 |
◊ |
D |
x-1,y,z |
1_455 |
6 |
4 |
24142 |
33.5 |
-0.0 |
0.619 |
0 |
0 |
0 |
0.000 |
21 |
34 |
|
[FE]D:602 |
1 |
1 |
137 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
19670 |
31.9 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.022 |
35 |
|
[FE]B:602 |
1 |
1 |
137 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
19949 |
31.5 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.022 |
Average: |
31.7 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.022 |
22 |
36 |
|
B |
1 |
1 |
24240 |
x |
B |
x-1,y,z |
1_455 |
1 |
1 |
24240 |
3.9 |
0.2 |
0.817 |
0 |
0 |
0 |
0.000 |
|