## |
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 |
170 |
47 |
15600 |
◊ |
A |
x,y,z |
1_555 |
173 |
49 |
15484 |
1656.2 |
-19.6 |
0.097 |
17 |
0 |
0 |
0.214 |
2 |
|
D |
175 |
48 |
15557 |
◊ |
C |
x,y,z |
1_555 |
171 |
48 |
15625 |
1643.9 |
-20.2 |
0.081 |
19 |
0 |
0 |
0.214 |
Average: |
1650.0 |
-19.9 |
0.089 |
18 |
0 |
0 |
0.214 |
2 |
3 |
|
[NAD]C:377 |
42 |
1 |
867 |
f |
C |
x,y,z |
1_555 |
70 |
35 |
15625 |
593.4 |
-8.0 |
0.425 |
13 |
0 |
0 |
0.227 |
4 |
|
[NAD]D:377 |
43 |
1 |
864 |
f |
D |
x,y,z |
1_555 |
75 |
35 |
15557 |
592.2 |
-10.4 |
0.227 |
14 |
0 |
0 |
0.227 |
5 |
|
[NAD]B:377 |
41 |
1 |
860 |
f |
B |
x,y,z |
1_555 |
69 |
35 |
15600 |
592.0 |
-7.9 |
0.425 |
13 |
0 |
0 |
0.227 |
6 |
|
[NAD]A:377 |
43 |
1 |
859 |
f |
A |
x,y,z |
1_555 |
75 |
35 |
15484 |
591.5 |
-8.0 |
0.429 |
13 |
0 |
0 |
0.227 |
Average: |
592.2 |
-8.6 |
0.377 |
13 |
0 |
0 |
0.227 |
3 |
7 |
|
B |
50 |
15 |
15600 |
◊ |
D |
x-1,y,z |
1_455 |
49 |
14 |
15557 |
463.4 |
3.3 |
0.891 |
9 |
4 |
0 |
0.000 |
4 |
8 |
|
A |
38 |
10 |
15484 |
◊ |
C |
x,y,z-1 |
1_554 |
36 |
10 |
15625 |
339.6 |
0.9 |
0.778 |
4 |
4 |
0 |
0.000 |
5 |
9 |
|
D |
27 |
10 |
15557 |
◊ |
C |
-x+2,y-1/2,-z+1 |
2_746 |
23 |
6 |
15625 |
256.2 |
-2.5 |
0.317 |
1 |
0 |
0 |
0.000 |
10 |
|
A |
18 |
6 |
15484 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
17 |
5 |
15600 |
173.2 |
0.1 |
0.668 |
1 |
2 |
0 |
0.000 |
Average: |
214.7 |
-1.2 |
0.492 |
1 |
1 |
0 |
0.000 |
6 |
11 |
|
C |
25 |
9 |
15625 |
◊ |
B |
x,y,z |
1_555 |
24 |
8 |
15600 |
199.7 |
1.7 |
0.831 |
1 |
0 |
0 |
0.000 |
7 |
12 |
|
B |
19 |
8 |
15600 |
◊ |
C |
x-1,y,z-1 |
1_454 |
16 |
5 |
15625 |
168.8 |
-0.7 |
0.574 |
0 |
0 |
0 |
0.000 |
8 |
13 |
|
A |
21 |
7 |
15484 |
◊ |
C |
-x+2,y-1/2,-z+1 |
2_746 |
17 |
6 |
15625 |
153.2 |
0.1 |
0.656 |
0 |
0 |
0 |
0.000 |
14 |
|
D |
17 |
7 |
15557 |
◊ |
B |
-x+2,y-1/2,-z+1 |
2_746 |
11 |
4 |
15600 |
119.5 |
-0.0 |
0.624 |
1 |
1 |
0 |
0.000 |
Average: |
136.3 |
0.0 |
0.640 |
1 |
1 |
0 |
0.000 |
9 |
15 |
|
D |
19 |
5 |
15557 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
18 |
8 |
15600 |
152.5 |
-0.2 |
0.639 |
1 |
0 |
0 |
0.000 |
16 |
|
A |
17 |
5 |
15484 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
17 |
6 |
15625 |
150.7 |
-0.7 |
0.563 |
0 |
0 |
0 |
0.000 |
Average: |
151.6 |
-0.5 |
0.601 |
1 |
0 |
0 |
0.000 |
10 |
17 |
|
[DFB]B:378 |
10 |
1 |
285 |
f |
B |
x,y,z |
1_555 |
22 |
12 |
15600 |
146.8 |
2.9 |
0.167 |
4 |
0 |
0 |
0.000 |
18 |
|
[DFB]C:378 |
10 |
1 |
286 |
f |
C |
x,y,z |
1_555 |
22 |
12 |
15625 |
145.3 |
2.9 |
0.157 |
4 |
0 |
0 |
0.000 |
19 |
|
[DFB]A:378 |
10 |
1 |
285 |
f |
A |
x,y,z |
1_555 |
22 |
12 |
15484 |
144.4 |
2.9 |
0.169 |
4 |
0 |
0 |
0.000 |
Average: |
145.5 |
2.9 |
0.164 |
4 |
0 |
0 |
0.000 |
11 |
20 |
|
[DFB]D:378 |
10 |
1 |
285 |
f |
D |
x,y,z |
1_555 |
24 |
14 |
15557 |
145.1 |
2.8 |
0.190 |
3 |
0 |
0 |
0.000 |
12 |
21 |
|
D |
17 |
5 |
15557 |
◊ |
A |
x,y,z |
1_555 |
15 |
8 |
15484 |
144.7 |
0.7 |
0.730 |
2 |
2 |
0 |
0.000 |
13 |
22 |
|
A |
17 |
6 |
15484 |
◊ |
D |
x-1,y,z-1 |
1_454 |
17 |
9 |
15557 |
134.5 |
0.2 |
0.681 |
1 |
2 |
0 |
0.000 |
14 |
23 |
|
C |
7 |
2 |
15625 |
◊ |
D |
x-1,y,z |
1_455 |
9 |
4 |
15557 |
69.6 |
0.2 |
0.676 |
0 |
0 |
0 |
0.000 |
24 |
|
B |
1 |
1 |
15600 |
◊ |
A |
x-1,y,z |
1_455 |
1 |
1 |
15484 |
0.5 |
0.0 |
0.658 |
0 |
0 |
0 |
0.000 |
Average: |
35.1 |
0.1 |
0.667 |
0 |
0 |
0 |
0.000 |
15 |
25 |
|
[DFB]D:378 |
8 |
1 |
285 |
f |
[NAD]D:377 |
x,y,z |
1_555 |
11 |
1 |
864 |
55.4 |
0.6 |
0.009 |
0 |
0 |
0 |
0.000 |
16 |
26 |
|
[DFB]C:378 |
6 |
1 |
286 |
f |
[NAD]C:377 |
x,y,z |
1_555 |
9 |
1 |
867 |
52.8 |
0.3 |
0.019 |
0 |
0 |
0 |
0.000 |
27 |
|
[DFB]B:378 |
5 |
1 |
285 |
f |
[NAD]B:377 |
x,y,z |
1_555 |
9 |
1 |
860 |
52.5 |
0.3 |
0.077 |
0 |
0 |
0 |
0.000 |
28 |
|
[DFB]A:378 |
6 |
1 |
285 |
f |
[NAD]A:377 |
x,y,z |
1_555 |
10 |
1 |
859 |
51.2 |
0.3 |
0.021 |
0 |
0 |
0 |
0.000 |
Average: |
52.1 |
0.3 |
0.039 |
0 |
0 |
0 |
0.000 |
17 |
29 |
|
D |
5 |
2 |
15557 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
15600 |
51.0 |
0.2 |
0.720 |
0 |
0 |
0 |
0.000 |
18 |
30 |
|
A |
2 |
1 |
15484 |
◊ |
C |
x-1,y,z-1 |
1_454 |
5 |
2 |
15625 |
32.1 |
0.1 |
0.649 |
0 |
0 |
0 |
0.000 |
19 |
31 |
|
[ZN]D:375 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
5 |
4 |
15557 |
30.8 |
-23.3 |
0.000 |
0 |
0 |
0 |
0.359 |
32 |
|
[ZN]B:375 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
4 |
15600 |
30.7 |
-23.3 |
0.000 |
0 |
0 |
0 |
0.359 |
33 |
|
[ZN]C:375 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
5 |
5 |
15625 |
30.7 |
-23.1 |
0.000 |
0 |
0 |
0 |
0.359 |
34 |
|
[ZN]A:375 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
4 |
4 |
15484 |
30.7 |
-23.3 |
0.000 |
0 |
0 |
0 |
0.359 |
Average: |
30.7 |
-23.3 |
0.000 |
0 |
0 |
0 |
0.359 |
20 |
35 |
|
[NAD]C:377 |
3 |
1 |
867 |
◊ |
D |
x,y,z |
1_555 |
4 |
1 |
15557 |
26.0 |
-0.1 |
0.432 |
0 |
0 |
0 |
0.002 |
36 |
|
[NAD]A:377 |
3 |
1 |
859 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
15600 |
25.2 |
-0.1 |
0.452 |
0 |
0 |
0 |
0.002 |
37 |
|
[NAD]D:377 |
3 |
1 |
864 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
15625 |
25.2 |
-0.1 |
0.389 |
0 |
0 |
0 |
0.002 |
38 |
|
[NAD]B:377 |
2 |
1 |
860 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
15484 |
24.7 |
-0.1 |
0.451 |
0 |
0 |
0 |
0.002 |
Average: |
25.3 |
-0.1 |
0.431 |
0 |
0 |
0 |
0.002 |
21 |
39 |
|
[DFB]C:378 |
2 |
1 |
286 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
15557 |
25.7 |
0.0 |
0.134 |
0 |
0 |
0 |
0.000 |
40 |
|
[DFB]A:378 |
2 |
1 |
285 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
15600 |
25.1 |
0.1 |
0.166 |
0 |
0 |
0 |
0.000 |
41 |
|
[DFB]B:378 |
2 |
1 |
285 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
15484 |
22.7 |
0.1 |
0.198 |
0 |
0 |
0 |
0.000 |
Average: |
24.5 |
0.1 |
0.166 |
0 |
0 |
0 |
0.000 |
22 |
42 |
|
[DFB]D:378 |
3 |
1 |
285 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
15625 |
25.2 |
0.3 |
0.121 |
0 |
0 |
0 |
0.000 |
23 |
43 |
|
[DFB]B:378 |
2 |
1 |
285 |
f |
[ZN]B:375 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.2 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.126 |
44 |
|
[DFB]A:378 |
2 |
1 |
285 |
f |
[ZN]A:375 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.2 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.126 |
45 |
|
[DFB]D:378 |
2 |
1 |
285 |
f |
[ZN]D:375 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.1 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.126 |
46 |
|
[DFB]C:378 |
2 |
1 |
286 |
f |
[ZN]C:375 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.1 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.126 |
Average: |
21.2 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.126 |
24 |
47 |
|
[NAD]B:377 |
3 |
1 |
860 |
f |
[ZN]B:375 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.0 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.118 |
48 |
|
[NAD]A:377 |
3 |
1 |
859 |
f |
[ZN]A:375 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.8 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.118 |
49 |
|
[NAD]C:377 |
3 |
1 |
867 |
f |
[ZN]C:375 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.5 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.118 |
50 |
|
[NAD]D:377 |
3 |
1 |
864 |
f |
[ZN]D:375 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.4 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.118 |
Average: |
20.7 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.118 |
25 |
51 |
|
B |
1 |
1 |
15600 |
x |
B |
x-1,y,z |
1_455 |
1 |
1 |
15600 |
0.3 |
0.0 |
0.655 |
0 |
0 |
0 |
0.000 |
|