## |
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 |
231 |
65 |
15277 |
◊ |
A |
x,y,z |
1_555 |
237 |
63 |
15439 |
2342.7 |
-33.3 |
0.011 |
28 |
8 |
0 |
0.689 |
2 |
|
D |
227 |
60 |
15317 |
◊ |
C |
x,y,z |
1_555 |
228 |
60 |
15539 |
2242.8 |
-31.4 |
0.013 |
26 |
10 |
0 |
0.689 |
Average: |
2292.7 |
-32.3 |
0.012 |
27 |
9 |
0 |
0.689 |
2 |
3 |
|
A |
51 |
13 |
15439 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
45 |
14 |
15277 |
427.2 |
-2.5 |
0.533 |
4 |
3 |
0 |
0.000 |
3 |
4 |
|
[GPD]A:501 |
34 |
1 |
735 |
◊ |
B |
x,y,z |
1_555 |
46 |
16 |
15277 |
378.4 |
-3.4 |
0.555 |
3 |
0 |
0 |
0.124 |
5 |
|
[GPD]A:500 |
35 |
1 |
738 |
◊ |
A |
x,y,z |
1_555 |
45 |
15 |
15439 |
378.3 |
-2.9 |
0.596 |
3 |
0 |
0 |
0.124 |
6 |
|
[GPD]D:500 |
35 |
1 |
729 |
◊ |
C |
x,y,z |
1_555 |
47 |
15 |
15539 |
376.8 |
-2.8 |
0.594 |
3 |
0 |
0 |
0.124 |
7 |
|
[GPD]D:501 |
35 |
1 |
731 |
◊ |
D |
x,y,z |
1_555 |
42 |
15 |
15317 |
361.6 |
-2.5 |
0.535 |
3 |
0 |
0 |
0.124 |
Average: |
373.8 |
-2.9 |
0.570 |
3 |
0 |
0 |
0.124 |
4 |
8 |
|
D |
34 |
14 |
15317 |
◊ |
A |
x,y,z |
1_555 |
34 |
15 |
15439 |
334.7 |
-1.5 |
0.551 |
0 |
0 |
0 |
0.000 |
9 |
|
C |
34 |
14 |
15539 |
◊ |
B |
x,y,z |
1_555 |
36 |
15 |
15277 |
328.0 |
-1.3 |
0.584 |
0 |
0 |
0 |
0.000 |
Average: |
331.4 |
-1.4 |
0.567 |
0 |
0 |
0 |
0.000 |
5 |
10 |
|
C |
35 |
10 |
15539 |
◊ |
A |
x,y,z-1 |
1_554 |
37 |
10 |
15439 |
299.9 |
2.1 |
0.844 |
5 |
1 |
0 |
0.000 |
6 |
11 |
|
[GPD]A:501 |
26 |
1 |
735 |
f |
A |
x,y,z |
1_555 |
29 |
9 |
15439 |
250.4 |
-5.6 |
0.416 |
7 |
0 |
0 |
0.233 |
12 |
|
[GPD]A:500 |
24 |
1 |
738 |
f |
B |
x,y,z |
1_555 |
28 |
9 |
15277 |
247.9 |
-5.0 |
0.460 |
7 |
0 |
0 |
0.233 |
13 |
|
[GPD]D:500 |
25 |
1 |
729 |
f |
D |
x,y,z |
1_555 |
29 |
10 |
15317 |
247.7 |
-5.1 |
0.455 |
8 |
0 |
0 |
0.233 |
14 |
|
[GPD]D:501 |
22 |
1 |
731 |
f |
C |
x,y,z |
1_555 |
24 |
10 |
15539 |
222.3 |
-2.5 |
0.638 |
6 |
0 |
0 |
0.233 |
Average: |
242.1 |
-4.5 |
0.492 |
7 |
0 |
0 |
0.233 |
7 |
15 |
|
D |
24 |
5 |
15317 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
32 |
10 |
15539 |
225.0 |
0.8 |
0.753 |
4 |
2 |
0 |
0.000 |
8 |
16 |
|
A |
20 |
5 |
15439 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
27 |
8 |
15277 |
183.3 |
-2.1 |
0.420 |
0 |
0 |
0 |
0.000 |
9 |
17 |
|
A |
21 |
7 |
15439 |
x |
A |
x-1,y,z |
1_455 |
24 |
9 |
15439 |
157.2 |
0.3 |
0.703 |
1 |
2 |
0 |
0.000 |
18 |
|
D |
19 |
6 |
15317 |
x |
D |
x-1,y,z |
1_455 |
21 |
7 |
15317 |
139.1 |
0.2 |
0.692 |
1 |
1 |
0 |
0.000 |
Average: |
148.1 |
0.2 |
0.698 |
1 |
2 |
0 |
0.000 |
10 |
19 |
|
D |
10 |
4 |
15317 |
◊ |
A |
x,y,z-1 |
1_554 |
16 |
6 |
15439 |
123.8 |
2.8 |
0.928 |
2 |
4 |
0 |
0.000 |
20 |
|
C |
14 |
6 |
15539 |
◊ |
B |
x,y,z-1 |
1_554 |
11 |
4 |
15277 |
123.4 |
2.6 |
0.917 |
3 |
4 |
0 |
0.000 |
Average: |
123.6 |
2.7 |
0.922 |
3 |
4 |
0 |
0.000 |
11 |
21 |
|
[EDO]D:1041 |
4 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
14 |
5 |
15317 |
111.7 |
2.2 |
0.378 |
1 |
0 |
0 |
0.000 |
12 |
22 |
|
B |
10 |
4 |
15277 |
◊ |
A |
x-1,y,z |
1_455 |
14 |
5 |
15439 |
89.4 |
0.9 |
0.776 |
0 |
0 |
0 |
0.000 |
23 |
|
D |
10 |
4 |
15317 |
◊ |
C |
x-1,y,z |
1_455 |
10 |
3 |
15539 |
69.0 |
0.1 |
0.634 |
0 |
0 |
0 |
0.000 |
Average: |
79.2 |
0.5 |
0.705 |
0 |
0 |
0 |
0.000 |
13 |
24 |
|
[EDO]B:1040 |
4 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
13 |
5 |
15539 |
69.9 |
1.9 |
0.267 |
1 |
0 |
0 |
0.000 |
14 |
25 |
|
[EDO]B:1040 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
15277 |
65.8 |
1.3 |
0.722 |
1 |
0 |
0 |
0.000 |
15 |
26 |
|
D |
5 |
3 |
15317 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
8 |
3 |
15539 |
56.5 |
0.2 |
0.701 |
1 |
2 |
0 |
0.000 |
16 |
27 |
|
B |
7 |
2 |
15277 |
x |
B |
x-1,y,z |
1_455 |
5 |
2 |
15277 |
43.1 |
-0.2 |
0.554 |
0 |
0 |
0 |
0.000 |
28 |
|
C |
2 |
1 |
15539 |
x |
C |
x-1,y,z |
1_455 |
5 |
1 |
15539 |
25.7 |
0.3 |
0.737 |
0 |
0 |
0 |
0.000 |
Average: |
34.4 |
0.0 |
0.645 |
0 |
0 |
0 |
0.000 |
17 |
29 |
|
D |
6 |
1 |
15317 |
◊ |
B |
x,y,z-1 |
1_554 |
5 |
1 |
15277 |
20.9 |
-0.0 |
0.632 |
0 |
0 |
0 |
0.000 |
|