## |
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 |
191 |
46 |
12339 |
◊ |
A |
x,y,z |
1_555 |
191 |
46 |
12352 |
1811.2 |
-19.5 |
0.152 |
30 |
14 |
0 |
0.646 |
2 |
|
D |
190 |
45 |
12522 |
◊ |
C |
x,y,z |
1_555 |
187 |
47 |
12170 |
1805.6 |
-21.5 |
0.099 |
32 |
15 |
0 |
0.646 |
Average: |
1808.4 |
-20.5 |
0.125 |
31 |
15 |
0 |
0.646 |
2 |
3 |
|
D |
179 |
48 |
12522 |
◊ |
B |
x,y,z |
1_555 |
174 |
47 |
12339 |
1679.6 |
-20.7 |
0.094 |
16 |
7 |
0 |
0.598 |
4 |
|
C |
170 |
47 |
12170 |
◊ |
A |
x,y,z |
1_555 |
172 |
48 |
12352 |
1603.2 |
-19.7 |
0.103 |
14 |
8 |
0 |
0.598 |
Average: |
1641.4 |
-20.2 |
0.099 |
15 |
8 |
0 |
0.598 |
3 |
5 |
|
[NAP]C:271 |
48 |
1 |
880 |
f |
C |
x,y,z |
1_555 |
91 |
36 |
12170 |
648.4 |
-4.1 |
0.602 |
20 |
0 |
0 |
0.574 |
6 |
|
[NAP]D:271 |
48 |
1 |
887 |
f |
D |
x,y,z |
1_555 |
91 |
37 |
12522 |
645.6 |
-3.9 |
0.603 |
20 |
0 |
0 |
0.574 |
7 |
|
[NAP]B:271 |
47 |
1 |
886 |
f |
B |
x,y,z |
1_555 |
91 |
36 |
12339 |
645.2 |
-4.1 |
0.597 |
20 |
0 |
0 |
0.574 |
8 |
|
[NAP]A:271 |
47 |
1 |
877 |
f |
A |
x,y,z |
1_555 |
93 |
37 |
12352 |
636.3 |
-3.7 |
0.602 |
21 |
0 |
0 |
0.574 |
Average: |
643.9 |
-4.0 |
0.601 |
20 |
0 |
0 |
0.574 |
4 |
9 |
|
A |
76 |
20 |
12352 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
66 |
22 |
12522 |
533.8 |
-1.0 |
0.695 |
4 |
1 |
0 |
0.000 |
5 |
10 |
|
B |
50 |
15 |
12339 |
◊ |
C |
x-1,y,z-1 |
1_454 |
44 |
15 |
12170 |
454.3 |
2.1 |
0.858 |
6 |
1 |
0 |
0.000 |
6 |
11 |
|
B |
48 |
18 |
12339 |
◊ |
D |
x-1,y,z |
1_455 |
46 |
16 |
12522 |
381.6 |
0.2 |
0.747 |
2 |
4 |
0 |
0.000 |
7 |
12 |
|
[CUE]D:272 |
20 |
1 |
420 |
f |
D |
x,y,z |
1_555 |
44 |
15 |
12522 |
298.2 |
-5.0 |
0.362 |
2 |
0 |
0 |
0.100 |
8 |
13 |
|
[CUE]B:272 |
20 |
1 |
416 |
f |
B |
x,y,z |
1_555 |
46 |
16 |
12339 |
294.1 |
-4.9 |
0.393 |
1 |
0 |
0 |
0.154 |
14 |
|
[CUE]A:272 |
20 |
1 |
415 |
f |
A |
x,y,z |
1_555 |
47 |
19 |
12352 |
291.1 |
-4.6 |
0.410 |
1 |
0 |
0 |
0.154 |
Average: |
292.6 |
-4.7 |
0.401 |
1 |
0 |
0 |
0.154 |
9 |
15 |
|
A |
17 |
6 |
12352 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
20 |
6 |
12170 |
176.2 |
-0.7 |
0.568 |
1 |
2 |
0 |
0.000 |
10 |
16 |
|
D |
28 |
9 |
12522 |
◊ |
C |
x,y,z-1 |
1_554 |
12 |
5 |
12170 |
162.3 |
-0.4 |
0.626 |
1 |
1 |
0 |
0.000 |
11 |
17 |
|
[EDO]C:272 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
21 |
11 |
12170 |
124.7 |
3.6 |
0.654 |
1 |
0 |
0 |
0.000 |
12 |
18 |
|
[EDO]D:274 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
17 |
7 |
12522 |
106.7 |
3.7 |
0.484 |
1 |
0 |
0 |
0.000 |
13 |
19 |
|
[EDO]C:273 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
18 |
8 |
12170 |
104.5 |
2.7 |
0.419 |
1 |
0 |
0 |
0.000 |
14 |
20 |
|
[EDO]A:276 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
12352 |
99.0 |
2.4 |
0.396 |
0 |
0 |
0 |
0.000 |
15 |
21 |
|
[EDO]A:275 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
12352 |
87.1 |
1.3 |
0.228 |
2 |
0 |
0 |
0.000 |
16 |
22 |
|
[EDO]A:273 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
12352 |
86.7 |
2.3 |
0.290 |
1 |
0 |
0 |
0.000 |
17 |
23 |
|
C |
8 |
4 |
12170 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
12339 |
86.0 |
0.9 |
0.769 |
2 |
0 |
0 |
0.002 |
24 |
|
D |
6 |
3 |
12522 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
12352 |
69.8 |
0.5 |
0.766 |
2 |
0 |
0 |
0.002 |
Average: |
77.9 |
0.7 |
0.767 |
2 |
0 |
0 |
0.002 |
18 |
25 |
|
[EDO]D:273 |
4 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
15 |
5 |
12522 |
81.8 |
2.6 |
0.487 |
0 |
0 |
0 |
0.000 |
19 |
26 |
|
[EDO]D:275 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
15 |
5 |
12522 |
75.6 |
1.5 |
0.248 |
1 |
0 |
0 |
0.000 |
20 |
27 |
|
[EDO]A:274 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
12352 |
61.8 |
1.4 |
0.815 |
1 |
0 |
0 |
0.000 |
21 |
28 |
|
B |
6 |
2 |
12339 |
◊ |
C |
x,y,z-1 |
1_554 |
6 |
3 |
12170 |
60.8 |
-0.6 |
0.475 |
0 |
0 |
0 |
0.000 |
22 |
29 |
|
[CUE]A:272 |
7 |
1 |
415 |
f |
[NAP]A:271 |
x,y,z |
1_555 |
7 |
1 |
877 |
50.3 |
-0.6 |
0.614 |
0 |
0 |
0 |
0.014 |
30 |
|
[CUE]B:272 |
6 |
1 |
416 |
f |
[NAP]B:271 |
x,y,z |
1_555 |
5 |
1 |
886 |
44.3 |
-0.4 |
0.621 |
0 |
0 |
0 |
0.014 |
Average: |
47.3 |
-0.5 |
0.617 |
0 |
0 |
0 |
0.014 |
23 |
31 |
|
[CUE]D:272 |
6 |
1 |
420 |
f |
[NAP]D:271 |
x,y,z |
1_555 |
5 |
1 |
887 |
42.4 |
-0.3 |
0.618 |
0 |
0 |
0 |
0.006 |
24 |
32 |
|
[EDO]A:273 |
3 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
6 |
2 |
12170 |
35.4 |
1.6 |
0.931 |
0 |
0 |
0 |
0.000 |
25 |
33 |
|
A |
7 |
3 |
12352 |
◊ |
D |
x-1,y,z |
1_455 |
6 |
2 |
12522 |
34.2 |
0.2 |
0.707 |
0 |
0 |
0 |
0.000 |
26 |
34 |
|
B |
5 |
1 |
12339 |
◊ |
A |
x,y,z-1 |
1_554 |
2 |
1 |
12352 |
33.8 |
-0.2 |
0.578 |
0 |
1 |
0 |
0.000 |
27 |
35 |
|
[EDO]A:276 |
2 |
1 |
184 |
f |
[EDO]A:275 |
x,y,z |
1_555 |
4 |
1 |
184 |
32.7 |
1.2 |
1.000 |
1 |
0 |
0 |
0.000 |
28 |
36 |
|
A |
5 |
3 |
12352 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
4 |
3 |
12339 |
21.2 |
-0.2 |
0.532 |
0 |
0 |
0 |
0.000 |
29 |
37 |
|
[EDO]D:273 |
2 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
12339 |
6.4 |
0.3 |
0.906 |
0 |
0 |
0 |
0.000 |
30 |
38 |
|
[EDO]A:275 |
1 |
1 |
184 |
f |
[CUE]A:272 |
x,y,z |
1_555 |
1 |
1 |
415 |
1.1 |
-0.0 |
0.837 |
0 |
0 |
0 |
0.000 |
|