## |
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 |
|
B |
484 |
123 |
16838 |
◊ |
A |
x,y,z |
1_555 |
493 |
123 |
17332 |
4880.1 |
-97.5 |
0.804 |
34 |
18 |
1 |
1.000 |
2 |
|
D |
446 |
116 |
15964 |
◊ |
C |
x,y,z |
1_555 |
444 |
115 |
15046 |
4429.5 |
-93.2 |
0.947 |
32 |
6 |
1 |
1.000 |
Average: |
4654.8 |
-95.3 |
0.876 |
33 |
12 |
1 |
1.000 |
2 |
3 |
|
B |
36 |
10 |
16838 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
34 |
9 |
15964 |
309.9 |
-3.3 |
0.898 |
2 |
2 |
0 |
0.000 |
3 |
4 |
|
[PC1]B:801 |
11 |
1 |
409 |
f |
B |
x,y,z |
1_555 |
33 |
11 |
16838 |
254.9 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.100 |
5 |
|
[PC1]A:605 |
11 |
1 |
407 |
f |
A |
x,y,z |
1_555 |
32 |
10 |
17332 |
246.9 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.100 |
Average: |
250.9 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.100 |
4 |
6 |
|
[TRD]A:606 |
13 |
1 |
460 |
◊ |
A |
x,y,z |
1_555 |
35 |
15 |
17332 |
239.9 |
4.9 |
0.505 |
0 |
0 |
0 |
0.000 |
5 |
7 |
|
[TRD]B:802 |
13 |
1 |
465 |
◊ |
B |
x,y,z |
1_555 |
32 |
15 |
16838 |
233.5 |
1.9 |
0.217 |
0 |
0 |
0 |
0.000 |
6 |
8 |
|
[PC1]A:604 |
11 |
1 |
413 |
f |
A |
x,y,z |
1_555 |
33 |
12 |
17332 |
229.5 |
-5.4 |
0.518 |
0 |
0 |
0 |
0.076 |
9 |
|
[PC1]B:803 |
11 |
1 |
410 |
f |
B |
x,y,z |
1_555 |
29 |
12 |
16838 |
223.3 |
-5.6 |
0.499 |
0 |
0 |
0 |
0.076 |
Average: |
226.4 |
-5.5 |
0.508 |
0 |
0 |
0 |
0.076 |
7 |
10 |
|
[TRD]D:401 |
13 |
1 |
461 |
◊ |
D |
x,y,z |
1_555 |
33 |
15 |
15964 |
219.3 |
2.1 |
0.255 |
0 |
0 |
0 |
0.000 |
8 |
11 |
|
[TRD]C:604 |
10 |
1 |
378 |
◊ |
C |
x,y,z |
1_555 |
29 |
12 |
15046 |
169.0 |
1.2 |
0.357 |
0 |
0 |
0 |
0.000 |
9 |
12 |
|
B |
18 |
4 |
16838 |
◊ |
D |
x-1,y,z+1 |
1_456 |
16 |
5 |
15964 |
167.5 |
-2.3 |
0.715 |
0 |
0 |
0 |
0.000 |
10 |
13 |
|
[TRD]A:606 |
6 |
1 |
460 |
◊ |
B |
x,y,z |
1_555 |
14 |
5 |
16838 |
77.4 |
-1.1 |
0.138 |
0 |
0 |
0 |
0.002 |
11 |
14 |
|
[TRD]D:401 |
9 |
1 |
461 |
◊ |
C |
x,y,z |
1_555 |
14 |
6 |
15046 |
76.7 |
2.0 |
0.293 |
0 |
0 |
0 |
0.000 |
12 |
15 |
|
[TRD]B:802 |
5 |
1 |
465 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
17332 |
74.0 |
1.9 |
0.469 |
0 |
0 |
0 |
0.000 |
13 |
16 |
|
[K]C:601 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
13 |
9 |
15046 |
61.9 |
-41.5 |
0.000 |
0 |
0 |
0 |
0.192 |
17 |
|
[K]A:601 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
14 |
9 |
17332 |
61.3 |
-41.7 |
0.000 |
0 |
0 |
0 |
0.192 |
18 |
|
[K]A:601 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
13 |
9 |
16838 |
61.3 |
-40.7 |
0.000 |
0 |
0 |
0 |
0.192 |
19 |
|
[K]C:601 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
14 |
9 |
15964 |
61.2 |
-40.4 |
0.000 |
0 |
0 |
0 |
0.192 |
Average: |
61.4 |
-41.1 |
0.000 |
0 |
0 |
0 |
0.192 |
14 |
20 |
|
[TRD]C:604 |
7 |
1 |
378 |
◊ |
D |
x,y,z |
1_555 |
11 |
5 |
15964 |
57.6 |
0.5 |
0.315 |
0 |
0 |
0 |
0.000 |
15 |
21 |
|
[K]C:602 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
15 |
6 |
15046 |
55.2 |
-38.0 |
0.000 |
0 |
0 |
0 |
0.172 |
22 |
|
[K]A:602 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
17332 |
54.8 |
-37.7 |
0.000 |
0 |
0 |
0 |
0.172 |
23 |
|
[K]A:602 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
14 |
6 |
16838 |
53.4 |
-35.8 |
0.000 |
0 |
0 |
0 |
0.172 |
24 |
|
[K]C:602 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
16 |
6 |
15964 |
53.3 |
-35.5 |
0.000 |
0 |
0 |
0 |
0.172 |
Average: |
54.2 |
-36.8 |
0.000 |
0 |
0 |
0 |
0.172 |
16 |
25 |
|
[K]A:603 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
17332 |
53.6 |
-35.9 |
0.000 |
0 |
0 |
0 |
0.163 |
26 |
|
[K]C:603 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
13 |
5 |
15046 |
53.5 |
-35.8 |
0.000 |
0 |
0 |
0 |
0.163 |
27 |
|
[K]A:603 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
16838 |
52.8 |
-34.9 |
0.000 |
0 |
0 |
0 |
0.163 |
28 |
|
[K]C:603 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
12 |
5 |
15964 |
50.6 |
-33.8 |
0.000 |
0 |
0 |
0 |
0.163 |
Average: |
52.6 |
-35.1 |
0.000 |
0 |
0 |
0 |
0.163 |
17 |
29 |
|
[TRD]D:401 |
5 |
1 |
461 |
f |
[TRD]C:604 |
x,y,z |
1_555 |
5 |
1 |
378 |
50.9 |
2.2 |
0.124 |
0 |
0 |
0 |
0.000 |
18 |
30 |
|
B |
8 |
2 |
16838 |
x |
B |
-x,y-1/2,-z+1 |
2_546 |
3 |
1 |
16838 |
47.5 |
2.0 |
0.963 |
3 |
4 |
0 |
0.000 |
19 |
31 |
|
[K]C:602 |
1 |
1 |
216 |
f |
[K]C:601 |
x,y,z |
1_555 |
1 |
1 |
216 |
37.1 |
-37.1 |
0.000 |
0 |
0 |
0 |
0.087 |
20 |
32 |
|
C |
3 |
2 |
15046 |
◊ |
A |
x,y,z-1 |
1_554 |
4 |
2 |
17332 |
37.1 |
-1.0 |
0.405 |
0 |
0 |
0 |
0.000 |
21 |
33 |
|
[K]A:602 |
1 |
1 |
216 |
f |
[K]A:601 |
x,y,z |
1_555 |
1 |
1 |
216 |
36.9 |
-36.9 |
0.000 |
0 |
0 |
0 |
0.081 |
22 |
34 |
|
[K]C:603 |
1 |
1 |
216 |
f |
[K]C:602 |
x,y,z |
1_555 |
1 |
1 |
216 |
34.3 |
-34.3 |
0.000 |
0 |
0 |
0 |
0.081 |
23 |
35 |
|
[K]A:603 |
1 |
1 |
216 |
f |
[K]A:602 |
x,y,z |
1_555 |
1 |
1 |
216 |
34.2 |
-34.2 |
0.000 |
0 |
0 |
0 |
0.075 |
24 |
36 |
|
[TRD]C:604 |
2 |
1 |
378 |
f |
[K]C:603 |
x,y,z |
1_555 |
1 |
1 |
216 |
25.0 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.017 |
37 |
|
[TRD]A:606 |
3 |
1 |
460 |
f |
[K]A:603 |
x,y,z |
1_555 |
1 |
1 |
216 |
20.8 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.017 |
Average: |
22.9 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.017 |
25 |
38 |
|
[TRD]B:802 |
3 |
1 |
465 |
f |
[TRD]A:606 |
x,y,z |
1_555 |
3 |
1 |
460 |
23.7 |
1.2 |
0.164 |
0 |
0 |
0 |
0.000 |
26 |
39 |
|
[TRD]B:802 |
3 |
1 |
465 |
f |
[K]A:603 |
x,y,z |
1_555 |
1 |
1 |
216 |
19.6 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.013 |
27 |
40 |
|
[TRD]D:401 |
4 |
1 |
461 |
f |
[K]C:603 |
x,y,z |
1_555 |
1 |
1 |
216 |
19.0 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.014 |
28 |
41 |
|
[K]C:603 |
1 |
1 |
216 |
f |
[K]C:601 |
x,y,z |
1_555 |
1 |
1 |
216 |
11.9 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.028 |
29 |
42 |
|
[K]A:603 |
1 |
1 |
216 |
f |
[K]A:601 |
x,y,z |
1_555 |
1 |
1 |
216 |
11.6 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.025 |
30 |
43 |
|
A |
1 |
1 |
17332 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
17332 |
8.1 |
-0.3 |
0.332 |
0 |
0 |
0 |
0.000 |
|