| ## |
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 |
124 |
35 |
16449 |
◊ |
A |
x,y,z |
1_555 |
119 |
33 |
16512 |
1147.2 |
-10.5 |
0.098 |
16 |
1 |
0 |
0.673 |
2 |
|
D |
123 |
34 |
16325 |
◊ |
B |
x,y,z |
1_555 |
121 |
32 |
16348 |
1143.4 |
-10.1 |
0.153 |
15 |
0 |
0 |
0.673 |
| Average: |
1145.3 |
-10.3 |
0.126 |
16 |
1 |
0 |
0.673 |
| 2 |
3 |
|
C |
39 |
11 |
16449 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
39 |
10 |
16325 |
361.2 |
7.6 |
0.980 |
7 |
8 |
0 |
0.000 |
| 3 |
4 |
|
[AMF]C:1446 |
22 |
1 |
558 |
f |
C |
x,y,z |
1_555 |
46 |
17 |
16449 |
315.5 |
-0.6 |
0.224 |
5 |
0 |
0 |
0.221 |
5 |
|
[AMF]A:1446 |
22 |
1 |
557 |
f |
A |
x,y,z |
1_555 |
49 |
17 |
16512 |
314.1 |
-0.7 |
0.261 |
5 |
0 |
0 |
0.221 |
6 |
|
[AMF]D:1446 |
22 |
1 |
553 |
f |
D |
x,y,z |
1_555 |
51 |
17 |
16325 |
311.2 |
-0.7 |
0.260 |
5 |
0 |
0 |
0.221 |
7 |
|
[AMF]B:1446 |
22 |
1 |
551 |
f |
B |
x,y,z |
1_555 |
52 |
17 |
16348 |
308.3 |
-0.5 |
0.287 |
5 |
0 |
0 |
0.221 |
| Average: |
312.3 |
-0.6 |
0.258 |
5 |
0 |
0 |
0.221 |
| 4 |
8 |
|
C |
43 |
14 |
16449 |
x |
C |
-x+1,y-1/2,-z |
2_645 |
31 |
10 |
16449 |
303.8 |
-2.4 |
0.319 |
1 |
0 |
0 |
0.000 |
9 |
|
D |
38 |
14 |
16325 |
x |
D |
-x+1,y-1/2,-z-1 |
2_644 |
23 |
9 |
16325 |
255.2 |
-1.2 |
0.475 |
1 |
0 |
0 |
0.000 |
| Average: |
279.5 |
-1.8 |
0.397 |
1 |
0 |
0 |
0.000 |
| 5 |
10 |
|
A |
29 |
9 |
16512 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
33 |
12 |
16449 |
295.3 |
3.3 |
0.859 |
5 |
5 |
0 |
0.000 |
11 |
|
B |
29 |
10 |
16348 |
◊ |
D |
-x+1,y-1/2,-z-1 |
2_644 |
32 |
10 |
16325 |
247.8 |
2.2 |
0.828 |
5 |
4 |
0 |
0.000 |
| Average: |
271.6 |
2.8 |
0.844 |
5 |
5 |
0 |
0.000 |
| 6 |
12 |
|
A |
35 |
7 |
16512 |
◊ |
C |
x-1,y,z |
1_455 |
28 |
9 |
16449 |
232.5 |
0.6 |
0.617 |
2 |
2 |
0 |
0.000 |
| 7 |
13 |
|
A |
23 |
8 |
16512 |
x |
A |
-x,y-1/2,-z |
2_545 |
32 |
13 |
16512 |
224.5 |
2.1 |
0.711 |
2 |
3 |
0 |
0.000 |
| 8 |
14 |
|
B |
29 |
7 |
16348 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
26 |
9 |
16512 |
204.4 |
-0.4 |
0.472 |
1 |
0 |
0 |
0.000 |
15 |
|
A |
26 |
7 |
16512 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
20 |
7 |
16348 |
203.9 |
-0.2 |
0.494 |
2 |
0 |
0 |
0.000 |
| Average: |
204.2 |
-0.3 |
0.483 |
2 |
0 |
0 |
0.000 |
| 9 |
16 |
|
D |
25 |
8 |
16325 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
23 |
9 |
16449 |
199.7 |
1.5 |
0.756 |
1 |
2 |
0 |
0.000 |
| 10 |
17 |
|
B |
21 |
7 |
16348 |
◊ |
D |
x-1,y,z |
1_455 |
24 |
7 |
16325 |
181.6 |
-0.7 |
0.462 |
0 |
0 |
0 |
0.000 |
| 11 |
18 |
|
[EDO]C:1448 |
4 |
1 |
183 |
◊ |
C |
x,y,z |
1_555 |
15 |
7 |
16449 |
101.3 |
2.0 |
0.292 |
0 |
0 |
0 |
0.000 |
| 12 |
19 |
|
[EDO]D:1448 |
4 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
15 |
5 |
16325 |
98.7 |
3.0 |
0.437 |
1 |
0 |
0 |
0.000 |
| 13 |
20 |
|
[ACT]C:1447 |
4 |
1 |
182 |
f |
C |
x,y,z |
1_555 |
17 |
5 |
16449 |
96.3 |
-0.8 |
0.514 |
0 |
0 |
0 |
0.029 |
| 14 |
21 |
|
[EDO]D:1449 |
4 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
11 |
5 |
16325 |
91.6 |
2.9 |
0.487 |
1 |
0 |
0 |
0.000 |
| 15 |
22 |
|
[EDO]D:1447 |
4 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
12 |
4 |
16325 |
87.6 |
2.7 |
0.487 |
3 |
0 |
0 |
0.000 |
| 16 |
23 |
|
[EDO]D:1450 |
4 |
1 |
185 |
◊ |
D |
-x+1,y-1/2,-z-1 |
2_644 |
12 |
5 |
16325 |
81.8 |
2.0 |
0.211 |
0 |
0 |
0 |
0.000 |
| 17 |
24 |
|
B |
7 |
4 |
16348 |
x |
B |
-x,y-1/2,-z-1 |
2_544 |
7 |
2 |
16348 |
65.9 |
0.2 |
0.645 |
1 |
1 |
0 |
0.000 |
| 18 |
25 |
|
C |
10 |
4 |
16449 |
◊ |
[EDO]D:1447 |
-x+1,y-1/2,-z |
2_645 |
4 |
1 |
183 |
65.8 |
1.7 |
0.830 |
0 |
0 |
0 |
0.000 |
| 19 |
26 |
|
[EDO]A:1447 |
3 |
1 |
182 |
◊ |
C |
x,y,z |
1_555 |
9 |
5 |
16449 |
63.8 |
1.1 |
0.732 |
1 |
0 |
0 |
0.000 |
| 20 |
27 |
|
C |
5 |
2 |
16449 |
f |
[EDO]D:1448 |
-x+1,y-1/2,-z |
2_645 |
4 |
1 |
184 |
47.7 |
1.7 |
0.967 |
2 |
0 |
0 |
0.000 |
| 21 |
28 |
|
B |
8 |
3 |
16348 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
5 |
1 |
16449 |
47.2 |
-0.4 |
0.452 |
0 |
0 |
0 |
0.000 |
| 22 |
29 |
|
B |
4 |
1 |
16348 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
16512 |
44.6 |
-1.0 |
0.255 |
0 |
0 |
0 |
0.000 |
| 23 |
30 |
|
[EDO]A:1447 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
16512 |
44.3 |
1.2 |
0.866 |
2 |
0 |
0 |
0.000 |
| 24 |
31 |
|
[EDO]A:1447 |
3 |
1 |
182 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
8 |
4 |
16449 |
40.0 |
1.2 |
0.246 |
0 |
0 |
0 |
0.000 |
| 25 |
32 |
|
B |
5 |
2 |
16348 |
◊ |
D |
x,y-1,z |
1_545 |
7 |
3 |
16325 |
39.9 |
-0.4 |
0.458 |
0 |
0 |
0 |
0.000 |
| 26 |
33 |
|
[CA]C:1449 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
16449 |
36.0 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.215 |
34 |
|
[CA]D:1451 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
6 |
3 |
16325 |
35.1 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.215 |
| Average: |
35.5 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.215 |
| 27 |
35 |
|
[EDO]D:1449 |
2 |
1 |
184 |
f |
C |
-x+1,y-1/2,-z |
2_645 |
3 |
1 |
16449 |
34.2 |
1.3 |
0.932 |
0 |
0 |
0 |
0.000 |
| 28 |
36 |
|
[EDO]D:1450 |
3 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
5 |
2 |
16325 |
34.2 |
0.7 |
0.802 |
0 |
0 |
0 |
0.000 |
| 29 |
37 |
|
A |
2 |
1 |
16512 |
◊ |
C |
x,y-1,z |
1_545 |
1 |
1 |
16449 |
5.8 |
-0.1 |
0.384 |
0 |
0 |
0 |
0.000 |
| 30 |
38 |
|
C |
1 |
1 |
16449 |
f |
[EDO]C:1448 |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
183 |
5.7 |
0.3 |
0.941 |
0 |
0 |
0 |
0.000 |
|