## |
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 |
50 |
16 |
14834 |
◊ |
A |
x,y,z |
1_555 |
48 |
16 |
14936 |
478.3 |
-7.1 |
0.286 |
4 |
0 |
0 |
0.000 |
2 |
|
B |
48 |
14 |
15216 |
◊ |
D |
x,y-1,z |
1_545 |
48 |
16 |
14852 |
475.6 |
-7.3 |
0.207 |
3 |
0 |
0 |
0.000 |
Average: |
477.0 |
-7.2 |
0.246 |
4 |
0 |
0 |
0.000 |
2 |
3 |
|
[FNQ]B:403 |
30 |
1 |
668 |
f |
B |
x,y,z |
1_555 |
64 |
23 |
15216 |
389.0 |
3.0 |
0.588 |
3 |
0 |
0 |
0.000 |
4 |
|
[FNQ]C:403 |
28 |
1 |
640 |
f |
C |
x,y,z |
1_555 |
61 |
21 |
14834 |
369.8 |
2.2 |
0.442 |
3 |
0 |
0 |
0.000 |
5 |
|
[FNQ]D:403 |
25 |
1 |
552 |
f |
D |
x,y,z |
1_555 |
57 |
21 |
14852 |
353.4 |
2.7 |
0.550 |
3 |
0 |
0 |
0.000 |
6 |
|
[FNQ]A:403 |
19 |
1 |
437 |
f |
A |
x,y,z |
1_555 |
56 |
18 |
14936 |
295.3 |
5.3 |
0.486 |
3 |
0 |
0 |
0.000 |
Average: |
351.9 |
3.3 |
0.517 |
3 |
0 |
0 |
0.000 |
3 |
7 |
|
B |
39 |
11 |
15216 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
37 |
9 |
14852 |
330.5 |
-0.7 |
0.775 |
2 |
0 |
0 |
0.000 |
8 |
|
C |
38 |
9 |
14834 |
◊ |
A |
-x-1,y-1/2,-z-1 |
2_444 |
38 |
10 |
14936 |
329.0 |
-2.7 |
0.568 |
2 |
0 |
0 |
0.000 |
Average: |
329.7 |
-1.7 |
0.671 |
2 |
0 |
0 |
0.000 |
4 |
9 |
|
B |
29 |
7 |
15216 |
◊ |
A |
x,y,z |
1_555 |
27 |
9 |
14936 |
256.2 |
-2.8 |
0.453 |
3 |
4 |
0 |
0.000 |
5 |
10 |
|
C |
27 |
9 |
14834 |
◊ |
B |
x,y,z |
1_555 |
27 |
13 |
15216 |
224.2 |
-2.7 |
0.458 |
2 |
0 |
0 |
0.000 |
6 |
11 |
|
C |
21 |
5 |
14834 |
◊ |
A |
x-1,y,z |
1_455 |
20 |
7 |
14936 |
188.6 |
0.4 |
0.840 |
1 |
2 |
0 |
0.000 |
12 |
|
B |
12 |
3 |
15216 |
◊ |
D |
x-1,y-1,z |
1_445 |
14 |
5 |
14852 |
111.0 |
1.1 |
0.853 |
0 |
0 |
0 |
0.000 |
Average: |
149.8 |
0.7 |
0.847 |
1 |
1 |
0 |
0.000 |
7 |
13 |
|
B |
16 |
6 |
15216 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
19 |
7 |
14852 |
143.8 |
-3.0 |
0.260 |
0 |
0 |
0 |
0.000 |
14 |
|
C |
12 |
2 |
14834 |
◊ |
A |
-x,y-1/2,-z-1 |
2_544 |
11 |
2 |
14936 |
106.1 |
-2.5 |
0.234 |
0 |
0 |
0 |
0.000 |
Average: |
125.0 |
-2.7 |
0.247 |
0 |
0 |
0 |
0.000 |
8 |
15 |
|
[DMS]D:404 |
4 |
1 |
207 |
f |
D |
x,y,z |
1_555 |
25 |
9 |
14852 |
138.9 |
3.6 |
0.698 |
1 |
0 |
0 |
0.000 |
9 |
16 |
|
[DMS]C:404 |
4 |
1 |
206 |
f |
C |
x,y,z |
1_555 |
19 |
7 |
14834 |
132.0 |
1.4 |
0.435 |
0 |
0 |
0 |
0.000 |
10 |
17 |
|
A |
13 |
4 |
14936 |
◊ |
D |
x-1,y,z |
1_455 |
11 |
3 |
14852 |
93.7 |
-2.3 |
0.265 |
0 |
0 |
0 |
0.000 |
11 |
18 |
|
[GOL]B:405 |
6 |
1 |
221 |
f |
D |
x,y-1,z |
1_545 |
14 |
6 |
14852 |
93.4 |
0.1 |
0.645 |
4 |
0 |
0 |
0.005 |
19 |
|
[GOL]A:405 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
14936 |
92.4 |
0.2 |
0.688 |
5 |
0 |
0 |
0.005 |
Average: |
92.9 |
0.1 |
0.666 |
5 |
0 |
0 |
0.005 |
12 |
20 |
|
[GOL]A:405 |
5 |
1 |
221 |
◊ |
C |
x,y,z |
1_555 |
16 |
6 |
14834 |
93.2 |
-0.2 |
0.604 |
4 |
0 |
0 |
0.000 |
21 |
|
[GOL]B:405 |
6 |
1 |
221 |
◊ |
B |
x,y,z |
1_555 |
16 |
6 |
15216 |
92.7 |
-0.1 |
0.642 |
4 |
0 |
0 |
0.000 |
Average: |
93.0 |
-0.2 |
0.623 |
4 |
0 |
0 |
0.000 |
13 |
22 |
|
[DMS]A:404 |
4 |
1 |
207 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
14936 |
75.4 |
0.3 |
0.420 |
0 |
0 |
0 |
0.000 |
14 |
23 |
|
[DMS]B:404 |
4 |
1 |
206 |
◊ |
B |
x,y,z |
1_555 |
12 |
4 |
15216 |
75.1 |
1.2 |
0.382 |
0 |
0 |
0 |
0.000 |
15 |
24 |
|
[CL]A:406 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
14936 |
73.2 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.021 |
25 |
|
[CL]B:406 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
15216 |
70.4 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.021 |
Average: |
71.8 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.021 |
16 |
26 |
|
C |
8 |
4 |
14834 |
◊ |
B |
x-1,y,z |
1_455 |
9 |
4 |
15216 |
69.2 |
-0.7 |
0.485 |
0 |
0 |
0 |
0.000 |
17 |
27 |
|
[ZN]D:401 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
11 |
6 |
14852 |
36.2 |
-22.6 |
0.000 |
0 |
0 |
0 |
0.064 |
28 |
|
[ZN]C:401 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
14834 |
36.0 |
-23.1 |
0.000 |
0 |
0 |
0 |
0.064 |
29 |
|
[ZN]B:401 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
15216 |
35.7 |
-22.6 |
0.000 |
0 |
0 |
0 |
0.064 |
30 |
|
[ZN]A:401 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
14936 |
35.5 |
-22.8 |
0.000 |
0 |
0 |
0 |
0.064 |
Average: |
35.9 |
-22.8 |
0.000 |
0 |
0 |
0 |
0.064 |
18 |
31 |
|
[FNQ]A:403 |
5 |
1 |
437 |
f |
[ZN]A:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
34.2 |
-15.6 |
0.000 |
0 |
0 |
0 |
0.044 |
32 |
|
[FNQ]D:403 |
5 |
1 |
552 |
f |
[ZN]D:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
34.0 |
-15.7 |
0.000 |
0 |
0 |
0 |
0.044 |
33 |
|
[FNQ]C:403 |
4 |
1 |
640 |
f |
[ZN]C:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
33.9 |
-15.7 |
0.000 |
0 |
0 |
0 |
0.044 |
34 |
|
[FNQ]B:403 |
5 |
1 |
668 |
f |
[ZN]B:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
33.8 |
-15.8 |
0.000 |
0 |
0 |
0 |
0.044 |
Average: |
34.0 |
-15.7 |
0.000 |
0 |
0 |
0 |
0.044 |
19 |
35 |
|
C |
6 |
2 |
14834 |
◊ |
A |
x,y-1,z |
1_545 |
4 |
1 |
14936 |
33.6 |
-0.9 |
0.350 |
0 |
0 |
0 |
0.000 |
20 |
36 |
|
D |
5 |
3 |
14852 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
14936 |
27.1 |
-0.1 |
0.488 |
0 |
0 |
0 |
0.000 |
21 |
37 |
|
[DMS]A:404 |
2 |
1 |
207 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
15216 |
21.6 |
0.4 |
0.347 |
0 |
0 |
0 |
0.000 |
22 |
38 |
|
C |
1 |
1 |
14834 |
f |
[DMS]B:404 |
x-1,y,z |
1_455 |
1 |
1 |
206 |
1.2 |
-0.1 |
0.353 |
0 |
0 |
0 |
0.000 |
23 |
39 |
|
A |
1 |
1 |
14936 |
x |
A |
-x,y-1/2,-z-1 |
2_544 |
1 |
1 |
14936 |
0.2 |
0.0 |
0.658 |
0 |
0 |
0 |
0.000 |
|