## |
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 |
|
F |
103 |
37 |
20386 |
◊ |
C |
x,y,z |
1_555 |
104 |
35 |
20065 |
840.5 |
-6.4 |
0.558 |
6 |
8 |
0 |
0.000 |
2 |
2 |
|
E |
86 |
28 |
20226 |
◊ |
B |
x,y-1,z |
1_545 |
98 |
29 |
20196 |
768.3 |
-5.2 |
0.588 |
6 |
16 |
0 |
0.000 |
3 |
|
J |
87 |
26 |
20199 |
◊ |
H |
x,y,z |
1_555 |
85 |
27 |
20342 |
762.0 |
-6.8 |
0.411 |
8 |
8 |
0 |
0.000 |
4 |
|
I |
80 |
27 |
20409 |
◊ |
G |
x,y,z |
1_555 |
89 |
27 |
20648 |
751.5 |
-9.0 |
0.261 |
4 |
5 |
0 |
0.000 |
Average: |
760.6 |
-7.0 |
0.420 |
6 |
10 |
0 |
0.000 |
3 |
5 |
|
F |
84 |
31 |
20386 |
◊ |
B |
x,y,z |
1_555 |
82 |
33 |
20196 |
730.6 |
-2.5 |
0.734 |
8 |
1 |
0 |
0.000 |
6 |
|
E |
81 |
31 |
20226 |
◊ |
A |
x,y,z |
1_555 |
78 |
31 |
20289 |
692.6 |
-2.3 |
0.742 |
8 |
0 |
0 |
0.000 |
7 |
|
C |
66 |
29 |
20065 |
◊ |
D |
x-1,y+1,z |
1_465 |
72 |
28 |
20294 |
626.1 |
-3.2 |
0.643 |
7 |
2 |
0 |
0.000 |
Average: |
683.1 |
-2.7 |
0.706 |
8 |
1 |
0 |
0.000 |
4 |
8 |
|
D |
92 |
28 |
20294 |
◊ |
A |
x,y,z |
1_555 |
85 |
27 |
20289 |
724.2 |
-7.9 |
0.369 |
5 |
9 |
0 |
0.000 |
5 |
9 |
|
C |
44 |
15 |
20065 |
◊ |
B |
x,y,z-1 |
1_554 |
57 |
24 |
20196 |
478.0 |
-6.0 |
0.169 |
2 |
0 |
0 |
0.000 |
10 |
|
F |
42 |
14 |
20386 |
◊ |
D |
x,y,z |
1_555 |
51 |
22 |
20294 |
464.2 |
-6.9 |
0.112 |
2 |
0 |
0 |
0.000 |
Average: |
471.1 |
-6.4 |
0.141 |
2 |
0 |
0 |
0.000 |
6 |
11 |
|
H |
36 |
11 |
20342 |
◊ |
D |
x,y,z |
1_555 |
45 |
14 |
20294 |
399.5 |
-7.4 |
0.084 |
1 |
2 |
0 |
0.000 |
7 |
12 |
|
F |
40 |
16 |
20386 |
◊ |
A |
x,y,z |
1_555 |
38 |
16 |
20289 |
389.7 |
-5.0 |
0.241 |
0 |
0 |
0 |
0.061 |
13 |
|
E |
16 |
9 |
20226 |
◊ |
C |
x,y-1,z+1 |
1_546 |
20 |
8 |
20065 |
147.5 |
-3.0 |
0.221 |
0 |
0 |
0 |
0.061 |
Average: |
268.6 |
-4.0 |
0.231 |
0 |
0 |
0 |
0.061 |
8 |
14 |
|
G |
42 |
21 |
20648 |
◊ |
A |
x,y,z |
1_555 |
40 |
14 |
20289 |
341.9 |
-2.7 |
0.526 |
3 |
2 |
0 |
0.019 |
15 |
|
H |
34 |
20 |
20342 |
◊ |
E |
x,y,z-1 |
1_554 |
35 |
11 |
20226 |
339.9 |
-0.9 |
0.625 |
2 |
1 |
0 |
0.019 |
Average: |
340.9 |
-1.8 |
0.575 |
3 |
2 |
0 |
0.019 |
9 |
16 |
|
I |
40 |
13 |
20409 |
◊ |
B |
x,y,z |
1_555 |
41 |
11 |
20196 |
329.6 |
-2.8 |
0.494 |
4 |
0 |
0 |
0.069 |
10 |
17 |
|
G |
32 |
9 |
20648 |
◊ |
B |
x-1,y,z |
1_455 |
41 |
12 |
20196 |
322.5 |
-5.9 |
0.136 |
0 |
0 |
0 |
0.000 |
11 |
18 |
|
G |
28 |
9 |
20648 |
◊ |
A |
x-1,y,z |
1_455 |
26 |
10 |
20289 |
248.5 |
-2.7 |
0.390 |
2 |
0 |
0 |
0.000 |
19 |
|
E |
26 |
10 |
20226 |
◊ |
H |
x-1,y,z+1 |
1_456 |
29 |
9 |
20342 |
243.6 |
-2.9 |
0.353 |
2 |
0 |
0 |
0.000 |
Average: |
246.0 |
-2.8 |
0.371 |
2 |
0 |
0 |
0.000 |
12 |
20 |
|
G |
15 |
5 |
20648 |
◊ |
D |
x-1,y,z |
1_455 |
16 |
9 |
20294 |
158.3 |
-1.8 |
0.351 |
0 |
0 |
0 |
0.000 |
21 |
|
B |
3 |
3 |
20196 |
◊ |
H |
x-1,y+1,z+1 |
1_466 |
2 |
1 |
20342 |
20.7 |
-0.5 |
0.263 |
0 |
0 |
0 |
0.000 |
Average: |
89.5 |
-1.2 |
0.307 |
0 |
0 |
0 |
0.000 |
13 |
22 |
|
J |
20 |
8 |
20199 |
◊ |
I |
x,y,z-1 |
1_554 |
18 |
8 |
20409 |
156.4 |
-2.3 |
0.322 |
1 |
0 |
0 |
0.000 |
14 |
23 |
|
I |
15 |
8 |
20409 |
◊ |
E |
x,y,z |
1_555 |
21 |
11 |
20226 |
136.2 |
-1.0 |
0.556 |
0 |
0 |
0 |
0.000 |
15 |
24 |
|
[ACT]F:701 |
4 |
1 |
182 |
f |
F |
x,y,z |
1_555 |
19 |
12 |
20386 |
114.7 |
-1.9 |
0.459 |
0 |
0 |
0 |
0.023 |
16 |
25 |
|
J |
14 |
7 |
20199 |
◊ |
A |
x,y,z-1 |
1_554 |
18 |
7 |
20289 |
112.2 |
-0.3 |
0.628 |
0 |
0 |
0 |
0.000 |
17 |
26 |
|
[EDO]A:701 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
20289 |
110.2 |
4.1 |
0.714 |
4 |
0 |
0 |
0.000 |
18 |
27 |
|
J |
8 |
4 |
20199 |
◊ |
D |
x,y,z |
1_555 |
9 |
3 |
20294 |
88.1 |
-0.6 |
0.474 |
2 |
0 |
0 |
0.000 |
19 |
28 |
|
J |
11 |
4 |
20199 |
◊ |
B |
x,y,z-1 |
1_554 |
9 |
4 |
20196 |
87.9 |
-1.1 |
0.392 |
1 |
0 |
0 |
0.000 |
20 |
29 |
|
I |
12 |
3 |
20409 |
◊ |
A |
x,y,z |
1_555 |
8 |
5 |
20289 |
77.2 |
-0.3 |
0.527 |
0 |
0 |
0 |
0.000 |
21 |
30 |
|
[ACT]D:701 |
4 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
10 |
4 |
20294 |
70.3 |
-1.0 |
0.459 |
1 |
0 |
0 |
0.005 |
22 |
31 |
|
[ACT]D:701 |
4 |
1 |
183 |
◊ |
F |
x,y,z |
1_555 |
9 |
6 |
20386 |
66.3 |
-1.4 |
0.410 |
0 |
0 |
0 |
0.000 |
23 |
32 |
|
J |
5 |
2 |
20199 |
◊ |
G |
x,y,z |
1_555 |
4 |
2 |
20648 |
53.1 |
-0.2 |
0.507 |
1 |
0 |
0 |
0.000 |
24 |
33 |
|
C |
7 |
3 |
20065 |
◊ |
H |
x-1,y+1,z |
1_465 |
7 |
3 |
20342 |
48.7 |
-0.3 |
0.566 |
0 |
0 |
0 |
0.000 |
25 |
34 |
|
[ZN]D:703 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
11 |
4 |
20294 |
47.6 |
-25.4 |
0.000 |
0 |
0 |
0 |
0.599 |
35 |
|
[ZN]E:703 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
10 |
4 |
20226 |
47.1 |
-26.0 |
0.000 |
0 |
0 |
0 |
0.599 |
36 |
|
[ZN]A:703 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
20289 |
46.4 |
-24.8 |
0.000 |
0 |
0 |
0 |
0.599 |
37 |
|
[ZN]G:702 |
1 |
1 |
98 |
f |
G |
x,y,z |
1_555 |
11 |
4 |
20648 |
46.2 |
-25.2 |
0.000 |
0 |
0 |
0 |
0.599 |
38 |
|
[ZN]C:702 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
12 |
5 |
20065 |
46.1 |
-24.6 |
0.000 |
0 |
0 |
0 |
0.599 |
39 |
|
[ZN]H:702 |
1 |
1 |
98 |
f |
H |
x,y,z |
1_555 |
10 |
4 |
20342 |
45.9 |
-23.2 |
0.000 |
0 |
0 |
0 |
0.599 |
40 |
|
[ZN]F:703 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
9 |
4 |
20386 |
45.6 |
-24.4 |
0.000 |
0 |
0 |
0 |
0.599 |
41 |
|
[ZN]B:702 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
20196 |
44.9 |
-24.1 |
0.000 |
0 |
0 |
0 |
0.599 |
Average: |
46.2 |
-24.7 |
0.000 |
0 |
0 |
0 |
0.599 |
26 |
42 |
|
H |
12 |
6 |
20342 |
f |
[ZN]E:702 |
x,y,z-1 |
1_554 |
1 |
1 |
98 |
45.0 |
-21.6 |
0.000 |
0 |
0 |
0 |
0.212 |
27 |
43 |
|
[CA]B:701 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
2 |
2 |
20196 |
42.6 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.193 |
44 |
|
[CA]H:701 |
1 |
1 |
85 |
f |
H |
x,y,z |
1_555 |
1 |
1 |
20342 |
42.6 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.193 |
Average: |
42.6 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.193 |
28 |
45 |
|
G |
4 |
1 |
20648 |
◊ |
F |
x,y,z |
1_555 |
4 |
1 |
20386 |
38.6 |
0.9 |
0.864 |
0 |
0 |
0 |
0.000 |
29 |
46 |
|
[ZN]A:704 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
20289 |
36.4 |
-17.2 |
0.000 |
0 |
0 |
0 |
0.209 |
30 |
47 |
|
[ZN]E:702 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
5 |
2 |
20226 |
35.0 |
-16.4 |
0.000 |
0 |
0 |
0 |
0.216 |
48 |
|
[ZN]I:702 |
1 |
1 |
98 |
◊ |
I |
x,y,z |
1_555 |
5 |
2 |
20409 |
32.8 |
-14.2 |
0.000 |
0 |
0 |
0 |
0.216 |
Average: |
33.9 |
-15.3 |
0.000 |
0 |
0 |
0 |
0.216 |
31 |
49 |
|
J |
6 |
3 |
20199 |
◊ |
E |
x,y,z-1 |
1_554 |
4 |
1 |
20226 |
33.6 |
-0.3 |
0.445 |
0 |
0 |
0 |
0.000 |
32 |
50 |
|
I |
4 |
3 |
20409 |
◊ |
H |
x-1,y+1,z+1 |
1_466 |
7 |
4 |
20342 |
29.9 |
-0.7 |
0.376 |
0 |
0 |
0 |
0.000 |
33 |
51 |
|
[ZN]A:704 |
1 |
1 |
98 |
◊ |
F |
x,y,z |
1_555 |
5 |
3 |
20386 |
27.4 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.136 |
34 |
52 |
|
[ZN]I:702 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
20196 |
24.6 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.158 |
35 |
53 |
|
I |
1 |
1 |
20409 |
◊ |
J |
x-1,y,z+1 |
1_456 |
3 |
1 |
20199 |
17.8 |
1.0 |
0.931 |
0 |
0 |
0 |
0.000 |
|