## |
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 |
|
M |
377 |
99 |
20082 |
◊ |
T |
x,y,z |
1_555 |
365 |
93 |
12885 |
3615.1 |
-34.5 |
0.067 |
54 |
10 |
0 |
0.402 |
2 |
|
L |
374 |
101 |
20151 |
◊ |
S |
x,y,z |
1_555 |
363 |
91 |
12782 |
3607.7 |
-31.5 |
0.098 |
53 |
9 |
0 |
0.402 |
Average: |
3611.4 |
-33.0 |
0.082 |
54 |
10 |
0 |
0.402 |
2 |
3 |
|
L |
72 |
17 |
20151 |
◊ |
T |
x,y,z |
1_555 |
90 |
24 |
12885 |
735.6 |
-13.2 |
0.020 |
5 |
1 |
0 |
0.165 |
4 |
|
M |
69 |
16 |
20082 |
◊ |
S |
x,y,z |
1_555 |
90 |
24 |
12782 |
735.4 |
-13.1 |
0.018 |
5 |
1 |
0 |
0.165 |
Average: |
735.5 |
-13.1 |
0.019 |
5 |
1 |
0 |
0.165 |
3 |
5 |
|
T |
84 |
24 |
12885 |
◊ |
S |
x,y,z |
1_555 |
82 |
24 |
12782 |
711.3 |
1.4 |
0.868 |
10 |
8 |
0 |
0.013 |
4 |
6 |
|
L |
61 |
17 |
20151 |
◊ |
M |
x-1/2,-y+5/2,-z |
4_475 |
61 |
17 |
20082 |
550.0 |
-4.2 |
0.354 |
9 |
0 |
0 |
0.000 |
5 |
7 |
|
M |
53 |
16 |
20082 |
◊ |
L |
x,y,z |
1_555 |
54 |
16 |
20151 |
496.4 |
1.8 |
0.840 |
8 |
7 |
0 |
0.008 |
6 |
8 |
|
L |
40 |
14 |
20151 |
x |
L |
-x+2,y-1/2,-z+1/2 |
3_745 |
32 |
10 |
20151 |
294.9 |
0.5 |
0.706 |
1 |
0 |
0 |
0.000 |
7 |
9 |
|
T |
28 |
10 |
12885 |
◊ |
L |
-x+3/2,-y+2,z-1/2 |
2_674 |
24 |
10 |
20151 |
202.7 |
1.2 |
0.787 |
3 |
2 |
0 |
0.000 |
8 |
10 |
|
L |
22 |
10 |
20151 |
◊ |
S |
-x+2,y-1/2,-z+1/2 |
3_745 |
19 |
7 |
12782 |
201.0 |
-0.4 |
0.605 |
1 |
3 |
0 |
0.000 |
9 |
11 |
|
[SF4]T:301 |
8 |
1 |
309 |
f |
T |
x,y,z |
1_555 |
25 |
14 |
12885 |
187.8 |
-20.4 |
0.553 |
0 |
0 |
0 |
0.216 |
12 |
|
[SF4]S:301 |
8 |
1 |
309 |
f |
S |
x,y,z |
1_555 |
25 |
14 |
12782 |
187.2 |
-20.2 |
0.590 |
0 |
0 |
0 |
0.216 |
Average: |
187.5 |
-20.3 |
0.572 |
0 |
0 |
0 |
0.216 |
10 |
13 |
|
[SF4]T:303 |
8 |
1 |
308 |
f |
T |
x,y,z |
1_555 |
30 |
15 |
12885 |
174.1 |
-18.5 |
0.214 |
2 |
0 |
0 |
0.205 |
11 |
14 |
|
[SF4]S:303 |
8 |
1 |
309 |
f |
S |
x,y,z |
1_555 |
31 |
15 |
12782 |
173.9 |
-18.5 |
0.216 |
2 |
0 |
0 |
0.203 |
12 |
15 |
|
[F3S]T:302 |
7 |
1 |
302 |
f |
T |
x,y,z |
1_555 |
29 |
15 |
12885 |
170.8 |
-16.3 |
0.341 |
1 |
0 |
0 |
0.177 |
16 |
|
[F3S]S:302 |
7 |
1 |
303 |
f |
S |
x,y,z |
1_555 |
28 |
15 |
12782 |
170.7 |
-16.3 |
0.316 |
1 |
0 |
0 |
0.177 |
Average: |
170.7 |
-16.3 |
0.328 |
1 |
0 |
0 |
0.177 |
13 |
17 |
|
[DTN]L:605 |
6 |
1 |
235 |
f |
L |
x,y,z |
1_555 |
20 |
7 |
20151 |
133.5 |
-1.2 |
0.660 |
4 |
0 |
0 |
0.031 |
14 |
18 |
|
M |
12 |
3 |
20082 |
x |
M |
-x+2,y-1/2,-z-1/2 |
3_744 |
10 |
4 |
20082 |
128.0 |
1.4 |
0.830 |
2 |
0 |
0 |
0.000 |
15 |
19 |
|
[FCO]M:601 |
7 |
1 |
262 |
f |
M |
x,y,z |
1_555 |
17 |
11 |
20082 |
127.5 |
-1.9 |
0.278 |
0 |
0 |
0 |
0.020 |
20 |
|
[FCO]L:601 |
7 |
1 |
261 |
f |
L |
x,y,z |
1_555 |
18 |
11 |
20151 |
126.7 |
-1.8 |
0.288 |
0 |
0 |
0 |
0.020 |
Average: |
127.1 |
-1.8 |
0.283 |
0 |
0 |
0 |
0.020 |
16 |
21 |
|
[DTN]M:605 |
6 |
1 |
227 |
f |
M |
x,y,z |
1_555 |
18 |
7 |
20082 |
125.9 |
-2.8 |
0.510 |
3 |
0 |
0 |
0.043 |
17 |
22 |
|
L |
15 |
7 |
20151 |
◊ |
M |
x-1/2,-y+3/2,-z |
4_465 |
15 |
6 |
20082 |
122.8 |
-0.0 |
0.612 |
0 |
0 |
0 |
0.000 |
18 |
23 |
|
[DTN]L:604 |
6 |
1 |
237 |
◊ |
L |
x,y,z |
1_555 |
13 |
3 |
20151 |
99.1 |
0.6 |
0.896 |
5 |
0 |
0 |
0.011 |
24 |
|
[DTN]M:604 |
5 |
1 |
237 |
◊ |
M |
x,y,z |
1_555 |
12 |
3 |
20082 |
91.9 |
0.6 |
0.839 |
5 |
0 |
0 |
0.011 |
Average: |
95.5 |
0.6 |
0.867 |
5 |
0 |
0 |
0.011 |
19 |
25 |
|
[SF4]T:303 |
4 |
1 |
308 |
◊ |
M |
x,y,z |
1_555 |
11 |
5 |
20082 |
61.0 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.027 |
20 |
26 |
|
[SF4]S:303 |
4 |
1 |
309 |
◊ |
L |
x,y,z |
1_555 |
11 |
5 |
20151 |
61.0 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.032 |
21 |
27 |
|
[F3S]T:302 |
5 |
1 |
302 |
◊ |
M |
x,y,z |
1_555 |
7 |
4 |
20082 |
59.1 |
-2.8 |
0.000 |
1 |
0 |
0 |
0.022 |
28 |
|
[F3S]S:302 |
5 |
1 |
303 |
◊ |
L |
x,y,z |
1_555 |
7 |
4 |
20151 |
59.0 |
-2.8 |
0.000 |
1 |
0 |
0 |
0.022 |
Average: |
59.1 |
-2.8 |
0.000 |
1 |
0 |
0 |
0.022 |
22 |
29 |
|
[DTN]M:604 |
5 |
1 |
237 |
f |
T |
x,y,z |
1_555 |
6 |
4 |
12885 |
58.1 |
-1.9 |
0.399 |
0 |
0 |
0 |
0.021 |
30 |
|
[DTN]L:604 |
5 |
1 |
237 |
f |
S |
x,y,z |
1_555 |
6 |
4 |
12782 |
56.9 |
-2.0 |
0.406 |
0 |
0 |
0 |
0.021 |
Average: |
57.5 |
-2.0 |
0.403 |
0 |
0 |
0 |
0.021 |
23 |
31 |
|
[MG]M:603 |
1 |
1 |
98 |
f |
M |
x,y,z |
1_555 |
9 |
5 |
20082 |
52.1 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.102 |
32 |
|
[MG]L:603 |
1 |
1 |
98 |
f |
L |
x,y,z |
1_555 |
11 |
6 |
20151 |
51.2 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.102 |
Average: |
51.6 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.102 |
24 |
33 |
|
M |
2 |
2 |
20082 |
◊ |
T |
-x+2,y-1/2,-z-1/2 |
3_744 |
3 |
1 |
12885 |
40.8 |
-0.1 |
0.331 |
0 |
0 |
0 |
0.000 |
25 |
34 |
|
[DTN]M:604 |
3 |
1 |
237 |
◊ |
L |
x,y,z |
1_555 |
2 |
1 |
20151 |
35.0 |
0.7 |
0.912 |
1 |
0 |
0 |
0.000 |
35 |
|
[DTN]L:604 |
4 |
1 |
237 |
◊ |
M |
x,y,z |
1_555 |
2 |
1 |
20082 |
33.1 |
0.7 |
0.941 |
1 |
0 |
0 |
0.000 |
Average: |
34.0 |
0.7 |
0.927 |
1 |
0 |
0 |
0.000 |
26 |
36 |
|
[NI]L:602 |
1 |
1 |
115 |
f |
[FCO]L:601 |
x,y,z |
1_555 |
3 |
1 |
261 |
34.5 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.067 |
37 |
|
[NI]M:602 |
1 |
1 |
115 |
f |
[FCO]M:601 |
x,y,z |
1_555 |
3 |
1 |
262 |
34.4 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.067 |
Average: |
34.5 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.067 |
27 |
38 |
|
L |
5 |
3 |
20151 |
◊ |
T |
x-1/2,-y+5/2,-z |
4_475 |
5 |
2 |
12885 |
32.2 |
0.1 |
0.677 |
1 |
1 |
0 |
0.000 |
39 |
|
S |
2 |
1 |
12782 |
◊ |
M |
x-1/2,-y+5/2,-z |
4_475 |
4 |
2 |
20082 |
26.9 |
0.2 |
0.727 |
1 |
1 |
0 |
0.000 |
Average: |
29.5 |
0.2 |
0.702 |
1 |
1 |
0 |
0.000 |
28 |
40 |
|
M |
5 |
3 |
20082 |
◊ |
S |
-x+5/2,-y+2,z-1/2 |
2_774 |
4 |
2 |
12782 |
28.6 |
0.1 |
0.651 |
0 |
0 |
0 |
0.000 |
29 |
41 |
|
S |
2 |
2 |
12782 |
◊ |
T |
x-1/2,-y+5/2,-z |
4_475 |
2 |
2 |
12885 |
4.4 |
0.1 |
0.717 |
0 |
0 |
0 |
0.000 |
|