## |
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 |
197 |
55 |
11519 |
◊ |
I |
x,y,z |
1_555 |
193 |
52 |
12020 |
1726.9 |
-28.7 |
0.047 |
15 |
1 |
0 |
1.000 |
2 |
|
L |
187 |
50 |
11534 |
◊ |
H |
x,y,z |
1_555 |
188 |
50 |
11334 |
1681.4 |
-29.1 |
0.029 |
15 |
1 |
0 |
1.000 |
Average: |
1704.2 |
-28.9 |
0.038 |
15 |
1 |
0 |
1.000 |
2 |
3 |
|
I |
48 |
13 |
12020 |
◊ |
H |
x,y,z |
1_555 |
47 |
13 |
11334 |
412.2 |
1.7 |
0.905 |
14 |
0 |
0 |
0.000 |
3 |
4 |
|
M |
29 |
9 |
11519 |
◊ |
H |
-x+3/2,-y,z-1/2 |
2_654 |
38 |
13 |
11334 |
309.8 |
0.4 |
0.758 |
5 |
0 |
0 |
0.000 |
5 |
|
I |
38 |
13 |
12020 |
◊ |
L |
-x+1/2,-y,z-1/2 |
2_554 |
27 |
9 |
11534 |
290.7 |
0.5 |
0.782 |
6 |
0 |
0 |
0.000 |
Average: |
300.2 |
0.5 |
0.770 |
6 |
0 |
0 |
0.000 |
4 |
6 |
|
H |
30 |
11 |
11334 |
◊ |
I |
x-1/2,-y+1/2,-z |
4_455 |
32 |
11 |
12020 |
274.0 |
-4.8 |
0.249 |
0 |
0 |
0 |
0.000 |
5 |
7 |
|
[PG4]H:305 |
13 |
1 |
400 |
f |
H |
x,y,z |
1_555 |
34 |
13 |
11334 |
213.7 |
3.3 |
0.357 |
5 |
0 |
0 |
0.000 |
6 |
8 |
|
M |
18 |
5 |
11519 |
x |
M |
-x+3/2,-y,z-1/2 |
2_654 |
23 |
10 |
11519 |
189.3 |
1.6 |
0.793 |
2 |
2 |
0 |
0.000 |
9 |
|
L |
25 |
11 |
11534 |
x |
L |
-x+1/2,-y,z-1/2 |
2_554 |
20 |
6 |
11534 |
187.0 |
0.8 |
0.755 |
5 |
2 |
0 |
0.000 |
Average: |
188.1 |
1.2 |
0.774 |
4 |
2 |
0 |
0.000 |
7 |
10 |
|
L |
18 |
8 |
11534 |
◊ |
I |
x-1/2,-y-1/2,-z |
4_445 |
16 |
6 |
12020 |
165.7 |
0.2 |
0.686 |
4 |
0 |
0 |
0.000 |
8 |
11 |
|
M |
24 |
5 |
11519 |
◊ |
I |
-x+3/2,-y,z-1/2 |
2_654 |
16 |
4 |
12020 |
162.4 |
-1.9 |
0.342 |
1 |
0 |
0 |
0.000 |
12 |
|
H |
16 |
4 |
11334 |
◊ |
L |
-x+1/2,-y,z-1/2 |
2_554 |
25 |
5 |
11534 |
157.4 |
-1.9 |
0.300 |
1 |
0 |
0 |
0.000 |
Average: |
159.9 |
-1.9 |
0.321 |
1 |
0 |
0 |
0.000 |
9 |
13 |
|
[PEG]M:301 |
7 |
1 |
261 |
f |
M |
x,y,z |
1_555 |
22 |
10 |
11519 |
144.5 |
2.7 |
0.314 |
5 |
0 |
0 |
0.000 |
10 |
14 |
|
[PEG]I:302 |
7 |
1 |
260 |
◊ |
I |
x,y,z |
1_555 |
19 |
7 |
12020 |
141.8 |
3.4 |
0.452 |
1 |
0 |
0 |
0.000 |
11 |
15 |
|
[PEG]H:302 |
7 |
1 |
263 |
f |
H |
x,y,z |
1_555 |
18 |
8 |
11334 |
140.9 |
2.7 |
0.312 |
2 |
0 |
0 |
0.000 |
12 |
16 |
|
[PEG]L:301 |
7 |
1 |
257 |
f |
L |
x,y,z |
1_555 |
17 |
10 |
11534 |
138.5 |
1.7 |
0.255 |
3 |
0 |
0 |
0.000 |
13 |
17 |
|
[PEG]I:304 |
7 |
1 |
254 |
f |
I |
x,y,z |
1_555 |
20 |
7 |
12020 |
135.6 |
2.7 |
0.388 |
1 |
0 |
0 |
0.000 |
14 |
18 |
|
[PEG]H:304 |
7 |
1 |
259 |
◊ |
H |
x,y,z |
1_555 |
17 |
8 |
11334 |
129.5 |
2.5 |
0.357 |
1 |
0 |
0 |
0.000 |
15 |
19 |
|
[PEG]M:302 |
7 |
1 |
256 |
f |
M |
x,y,z |
1_555 |
13 |
8 |
11519 |
116.5 |
3.4 |
0.399 |
2 |
0 |
0 |
0.000 |
16 |
20 |
|
[PEG]I:305 |
7 |
1 |
261 |
f |
I |
x,y,z |
1_555 |
15 |
7 |
12020 |
114.4 |
1.1 |
0.216 |
1 |
0 |
0 |
0.000 |
17 |
21 |
|
[PEG]I:301 |
7 |
1 |
262 |
◊ |
I |
x,y,z |
1_555 |
16 |
7 |
12020 |
113.4 |
3.4 |
0.408 |
2 |
0 |
0 |
0.000 |
18 |
22 |
|
[PEG]H:303 |
6 |
1 |
250 |
f |
H |
x,y,z |
1_555 |
15 |
7 |
11334 |
109.0 |
0.8 |
0.232 |
2 |
0 |
0 |
0.003 |
19 |
23 |
|
[PEG]I:303 |
7 |
1 |
254 |
◊ |
I |
x,y,z |
1_555 |
15 |
5 |
12020 |
94.7 |
2.4 |
0.342 |
2 |
0 |
0 |
0.000 |
20 |
24 |
|
[PEG]H:301 |
7 |
1 |
258 |
f |
I |
x-1/2,-y+1/2,-z |
4_455 |
12 |
6 |
12020 |
93.9 |
1.3 |
0.205 |
1 |
0 |
0 |
0.000 |
21 |
25 |
|
[PEG]I:302 |
7 |
1 |
260 |
f |
H |
x,y,z |
1_555 |
9 |
5 |
11334 |
75.6 |
2.0 |
0.259 |
1 |
0 |
0 |
0.000 |
22 |
26 |
|
[PEG]I:303 |
6 |
1 |
254 |
◊ |
H |
x,y,z |
1_555 |
12 |
3 |
11334 |
73.2 |
1.8 |
0.313 |
0 |
0 |
0 |
0.000 |
23 |
27 |
|
[PEG]H:301 |
5 |
1 |
258 |
◊ |
H |
x,y,z |
1_555 |
5 |
2 |
11334 |
59.9 |
1.3 |
0.265 |
1 |
0 |
0 |
0.000 |
24 |
28 |
|
[PEG]I:301 |
3 |
1 |
262 |
f |
M |
x,y,z |
1_555 |
7 |
4 |
11519 |
56.0 |
0.2 |
0.256 |
0 |
0 |
0 |
0.000 |
25 |
29 |
|
H |
4 |
2 |
11334 |
x |
H |
-x+1,y-1/2,-z+1/2 |
3_645 |
6 |
3 |
11334 |
52.7 |
-0.2 |
0.460 |
0 |
0 |
0 |
0.000 |
26 |
30 |
|
[PEG]H:303 |
4 |
1 |
250 |
f |
[PEG]H:302 |
x,y,z |
1_555 |
3 |
1 |
263 |
41.8 |
2.0 |
0.187 |
0 |
0 |
0 |
0.000 |
27 |
31 |
|
[PEG]I:305 |
4 |
1 |
261 |
f |
[PEG]I:304 |
x,y,z |
1_555 |
4 |
1 |
254 |
37.9 |
-0.2 |
0.065 |
1 |
0 |
0 |
0.023 |
28 |
32 |
|
[PEG]I:303 |
3 |
1 |
254 |
◊ |
L |
-x+1/2,-y,z-1/2 |
2_554 |
4 |
1 |
11534 |
35.7 |
0.9 |
0.338 |
0 |
0 |
0 |
0.000 |
29 |
33 |
|
L |
4 |
2 |
11534 |
◊ |
I |
x-1/2,-y+1/2,-z |
4_455 |
4 |
2 |
12020 |
27.2 |
0.3 |
0.730 |
1 |
1 |
0 |
0.000 |
30 |
34 |
|
[PEG]I:303 |
3 |
1 |
254 |
f |
L |
x,y,z |
1_555 |
3 |
2 |
11534 |
18.8 |
0.2 |
0.297 |
0 |
0 |
0 |
0.000 |
31 |
35 |
|
[PEG]H:304 |
2 |
1 |
259 |
f |
L |
x,y,z |
1_555 |
5 |
3 |
11534 |
16.0 |
0.3 |
0.371 |
0 |
0 |
0 |
0.000 |
32 |
36 |
|
L |
2 |
2 |
11534 |
◊ |
M |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
11519 |
6.2 |
-0.1 |
0.449 |
0 |
0 |
0 |
0.000 |
33 |
37 |
|
H |
2 |
1 |
11334 |
◊ |
I |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
12020 |
5.6 |
-0.1 |
0.453 |
0 |
0 |
0 |
0.000 |
34 |
38 |
|
H |
1 |
1 |
11334 |
◊ |
M |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
11519 |
0.9 |
0.0 |
0.674 |
0 |
0 |
0 |
0.000 |
|