| ## |
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 |
302 |
73 |
13637 |
◊ |
A |
x,y,z |
1_555 |
287 |
72 |
13697 |
2862.4 |
-52.5 |
0.001 |
21 |
8 |
0 |
0.633 |
2 |
|
D |
266 |
68 |
13604 |
◊ |
C |
x,y,z |
1_555 |
258 |
65 |
12585 |
2499.4 |
-45.9 |
0.003 |
19 |
6 |
0 |
0.633 |
| Average: |
2680.9 |
-49.2 |
0.002 |
20 |
7 |
0 |
0.633 |
| 2 |
3 |
|
[NAP]C:1280 |
48 |
1 |
892 |
f |
C |
x,y,z |
1_555 |
84 |
33 |
12585 |
620.9 |
-4.6 |
0.562 |
19 |
0 |
0 |
0.284 |
4 |
|
[NAP]B:1290 |
48 |
1 |
884 |
f |
B |
x,y,z |
1_555 |
81 |
32 |
13637 |
619.6 |
-4.8 |
0.554 |
17 |
0 |
0 |
0.284 |
5 |
|
[NAP]D:1291 |
48 |
1 |
879 |
f |
D |
x,y,z |
1_555 |
85 |
33 |
13604 |
616.3 |
-5.0 |
0.571 |
18 |
0 |
0 |
0.284 |
6 |
|
[NAP]A:1290 |
48 |
1 |
886 |
f |
A |
x,y,z |
1_555 |
83 |
33 |
13697 |
614.8 |
-4.9 |
0.538 |
18 |
0 |
0 |
0.284 |
| Average: |
617.9 |
-4.8 |
0.556 |
18 |
0 |
0 |
0.284 |
| 3 |
7 |
|
A |
64 |
17 |
13697 |
◊ |
C |
-x,y-1/2,-z-1/2 |
3_544 |
70 |
16 |
12585 |
591.1 |
0.1 |
0.810 |
5 |
0 |
0 |
0.000 |
| 4 |
8 |
|
D |
47 |
10 |
13604 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
44 |
10 |
13637 |
419.6 |
-8.3 |
0.077 |
1 |
2 |
0 |
0.042 |
| 5 |
9 |
|
[HD2]D:1292 |
30 |
1 |
599 |
f |
D |
x,y,z |
1_555 |
60 |
23 |
13604 |
413.6 |
-2.5 |
0.326 |
2 |
0 |
0 |
0.070 |
10 |
|
[HD2]B:1291 |
30 |
1 |
603 |
f |
B |
x,y,z |
1_555 |
57 |
24 |
13637 |
377.0 |
-1.5 |
0.377 |
2 |
0 |
0 |
0.070 |
11 |
|
[HD2]C:1281 |
31 |
1 |
600 |
f |
C |
x,y,z |
1_555 |
59 |
24 |
12585 |
376.7 |
-2.1 |
0.353 |
2 |
0 |
0 |
0.070 |
12 |
|
[HD2]A:1291 |
30 |
1 |
598 |
f |
A |
x,y,z |
1_555 |
60 |
24 |
13697 |
376.3 |
-2.0 |
0.355 |
2 |
0 |
0 |
0.070 |
| Average: |
385.9 |
-2.0 |
0.353 |
2 |
0 |
0 |
0.070 |
| 6 |
13 |
|
C |
42 |
9 |
12585 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
38 |
9 |
13697 |
381.6 |
-9.6 |
0.024 |
0 |
0 |
0 |
0.045 |
| 7 |
14 |
|
B |
43 |
18 |
13637 |
x |
B |
x-1,y,z |
1_455 |
27 |
8 |
13637 |
265.8 |
2.4 |
0.865 |
2 |
4 |
0 |
0.000 |
15 |
|
D |
38 |
14 |
13604 |
x |
D |
x-1,y,z |
1_455 |
25 |
8 |
13604 |
228.1 |
1.1 |
0.821 |
0 |
0 |
0 |
0.000 |
| Average: |
247.0 |
1.8 |
0.843 |
1 |
2 |
0 |
0.000 |
| 8 |
16 |
|
D |
34 |
13 |
13604 |
◊ |
A |
x,y,z |
1_555 |
31 |
12 |
13697 |
265.5 |
-0.7 |
0.666 |
1 |
1 |
0 |
0.000 |
| 9 |
17 |
|
C |
36 |
13 |
12585 |
◊ |
B |
x,y,z |
1_555 |
30 |
12 |
13637 |
263.1 |
3.9 |
0.939 |
3 |
2 |
0 |
0.000 |
| 10 |
18 |
|
D |
29 |
7 |
13604 |
◊ |
B |
-x-1/2,-y,z-1/2 |
2_454 |
36 |
9 |
13637 |
259.6 |
-5.0 |
0.216 |
1 |
0 |
0 |
0.000 |
| 11 |
19 |
|
A |
27 |
10 |
13697 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
26 |
7 |
13637 |
238.2 |
-2.2 |
0.470 |
2 |
0 |
0 |
0.000 |
| 12 |
20 |
|
C |
27 |
7 |
12585 |
x |
C |
x-1/2,-y+1/2,-z-1 |
4_454 |
31 |
14 |
12585 |
235.0 |
0.1 |
0.694 |
2 |
0 |
0 |
0.000 |
| 13 |
21 |
|
D |
31 |
11 |
13604 |
◊ |
A |
x-1,y,z |
1_455 |
27 |
9 |
13697 |
234.3 |
1.2 |
0.833 |
2 |
0 |
0 |
0.000 |
| 14 |
22 |
|
B |
26 |
7 |
13637 |
◊ |
A |
x-1,y,z |
1_455 |
22 |
5 |
13697 |
208.5 |
-0.9 |
0.607 |
1 |
1 |
0 |
0.000 |
23 |
|
D |
18 |
7 |
13604 |
◊ |
C |
x-1,y,z |
1_455 |
19 |
5 |
12585 |
174.8 |
-0.3 |
0.651 |
1 |
1 |
0 |
0.000 |
| Average: |
191.7 |
-0.6 |
0.629 |
1 |
1 |
0 |
0.000 |
| 15 |
24 |
|
A |
26 |
6 |
13697 |
◊ |
B |
-x+1,y-1/2,-z-1/2 |
3_644 |
23 |
8 |
13637 |
195.9 |
2.2 |
0.872 |
3 |
0 |
0 |
0.000 |
| 16 |
25 |
|
A |
20 |
4 |
13697 |
x |
A |
x-1,y,z |
1_455 |
22 |
7 |
13697 |
148.2 |
-1.6 |
0.451 |
1 |
0 |
0 |
0.000 |
| 17 |
26 |
|
A |
9 |
1 |
13697 |
◊ |
B |
x-1,y,z |
1_455 |
14 |
5 |
13637 |
95.8 |
0.8 |
0.761 |
2 |
0 |
0 |
0.000 |
| 18 |
27 |
|
C |
11 |
5 |
12585 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
11 |
5 |
13637 |
91.2 |
-2.8 |
0.128 |
0 |
0 |
0 |
0.025 |
28 |
|
D |
10 |
6 |
13604 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
9 |
5 |
13697 |
79.4 |
-2.5 |
0.103 |
0 |
0 |
0 |
0.025 |
| Average: |
85.3 |
-2.7 |
0.115 |
0 |
0 |
0 |
0.025 |
| 19 |
29 |
|
[HD2]D:1292 |
9 |
1 |
599 |
f |
[NAP]D:1291 |
x,y,z |
1_555 |
15 |
1 |
879 |
85.9 |
-0.9 |
0.457 |
0 |
0 |
0 |
0.022 |
30 |
|
[HD2]C:1281 |
11 |
1 |
600 |
f |
[NAP]C:1280 |
x,y,z |
1_555 |
13 |
1 |
892 |
77.5 |
-1.1 |
0.425 |
0 |
0 |
0 |
0.022 |
31 |
|
[HD2]B:1291 |
10 |
1 |
603 |
f |
[NAP]B:1290 |
x,y,z |
1_555 |
14 |
1 |
884 |
77.3 |
-1.1 |
0.427 |
0 |
0 |
0 |
0.022 |
32 |
|
[HD2]A:1291 |
9 |
1 |
598 |
f |
[NAP]A:1290 |
x,y,z |
1_555 |
15 |
1 |
886 |
77.2 |
-1.0 |
0.450 |
0 |
0 |
0 |
0.022 |
| Average: |
79.5 |
-1.0 |
0.440 |
0 |
0 |
0 |
0.022 |
| 20 |
33 |
|
[HD2]B:1291 |
8 |
1 |
603 |
◊ |
A |
x,y,z |
1_555 |
13 |
3 |
13697 |
85.1 |
-2.1 |
0.199 |
0 |
0 |
0 |
0.039 |
34 |
|
[HD2]C:1281 |
9 |
1 |
600 |
◊ |
D |
x,y,z |
1_555 |
13 |
3 |
13604 |
80.5 |
-1.8 |
0.260 |
0 |
0 |
0 |
0.039 |
35 |
|
[HD2]A:1291 |
9 |
1 |
598 |
◊ |
B |
x,y,z |
1_555 |
13 |
3 |
13637 |
75.6 |
-1.8 |
0.255 |
0 |
0 |
0 |
0.039 |
| Average: |
80.4 |
-1.9 |
0.238 |
0 |
0 |
0 |
0.039 |
| 21 |
36 |
|
C |
6 |
2 |
12585 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
3 |
2 |
13697 |
51.5 |
0.6 |
0.783 |
1 |
0 |
0 |
0.000 |
| 22 |
37 |
|
D |
4 |
2 |
13604 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
5 |
2 |
13637 |
41.1 |
-0.4 |
0.384 |
0 |
0 |
0 |
0.000 |
| 23 |
38 |
|
D |
4 |
2 |
13604 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
13637 |
33.8 |
0.9 |
0.877 |
0 |
2 |
0 |
0.000 |
| 24 |
39 |
|
C |
3 |
1 |
12585 |
◊ |
B |
-x-1/2,-y,z-1/2 |
2_454 |
4 |
2 |
13637 |
24.3 |
-0.9 |
0.228 |
0 |
0 |
0 |
0.000 |
40 |
|
D |
1 |
1 |
13604 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
1 |
1 |
13697 |
6.1 |
0.1 |
0.538 |
0 |
0 |
0 |
0.000 |
| Average: |
15.2 |
-0.4 |
0.383 |
0 |
0 |
0 |
0.000 |
| 25 |
41 |
|
D |
3 |
2 |
13604 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
1 |
13637 |
23.7 |
0.2 |
0.561 |
0 |
0 |
0 |
0.000 |
| 26 |
42 |
|
C |
4 |
2 |
12585 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
13697 |
16.6 |
0.1 |
0.668 |
0 |
0 |
0 |
0.000 |
| 27 |
43 |
|
D |
2 |
1 |
13604 |
◊ |
[NAP]A:1290 |
x-1,y,z |
1_455 |
3 |
1 |
886 |
14.0 |
0.5 |
0.742 |
0 |
0 |
0 |
0.000 |
| 28 |
44 |
|
[HD2]D:1292 |
2 |
1 |
599 |
◊ |
B |
-x-1/2,-y,z-1/2 |
2_454 |
1 |
1 |
13637 |
4.8 |
-0.1 |
0.557 |
0 |
0 |
0 |
0.000 |
|