## |
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 |
91 |
22 |
17992 |
◊ |
B |
y,x,-z |
7_555 |
90 |
21 |
17992 |
973.0 |
-17.8 |
0.014 |
4 |
2 |
0 |
0.522 |
2 |
|
A |
88 |
21 |
18075 |
◊ |
A |
y,x,-z |
7_555 |
87 |
21 |
18075 |
964.9 |
-17.9 |
0.010 |
4 |
0 |
0 |
0.522 |
Average: |
968.9 |
-17.8 |
0.012 |
4 |
1 |
0 |
0.522 |
2 |
3 |
|
B |
100 |
29 |
17992 |
◊ |
A |
x,y,z |
1_555 |
100 |
28 |
18075 |
963.9 |
-4.0 |
0.649 |
8 |
2 |
0 |
0.141 |
3 |
4 |
|
B |
59 |
18 |
17992 |
◊ |
A |
y,x,-z |
7_555 |
59 |
19 |
18075 |
580.3 |
-9.5 |
0.100 |
6 |
0 |
0 |
0.218 |
4 |
5 |
|
B |
49 |
17 |
17992 |
◊ |
A |
-y-1/2,x-1/2,z-1/4 |
3_444 |
43 |
14 |
18075 |
474.6 |
-0.4 |
0.747 |
9 |
8 |
0 |
0.000 |
5 |
6 |
|
[0MV]A:501 |
22 |
1 |
483 |
f |
A |
x,y,z |
1_555 |
46 |
16 |
18075 |
305.7 |
-6.5 |
0.319 |
3 |
0 |
0 |
0.413 |
7 |
|
[0MV]B:501 |
22 |
1 |
484 |
f |
B |
x,y,z |
1_555 |
44 |
16 |
17992 |
298.2 |
-6.5 |
0.307 |
3 |
0 |
0 |
0.413 |
Average: |
301.9 |
-6.5 |
0.313 |
3 |
0 |
0 |
0.413 |
6 |
8 |
|
[PIS]B:502 |
9 |
1 |
282 |
f |
B |
x,y,z |
1_555 |
25 |
14 |
17992 |
168.6 |
-1.8 |
0.677 |
12 |
0 |
0 |
0.417 |
9 |
|
[PIS]A:502 |
9 |
1 |
282 |
f |
A |
x,y,z |
1_555 |
23 |
13 |
18075 |
167.0 |
-2.3 |
0.714 |
13 |
0 |
0 |
0.417 |
Average: |
167.8 |
-2.0 |
0.696 |
13 |
0 |
0 |
0.417 |
7 |
10 |
|
A |
10 |
4 |
18075 |
◊ |
A |
-y,-x,-z-1/2 |
8_554 |
12 |
4 |
18075 |
122.5 |
0.9 |
0.825 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
[EDO]A:504 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
18075 |
98.6 |
2.3 |
0.449 |
2 |
0 |
0 |
0.000 |
9 |
12 |
|
[EDO]B:503 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
17992 |
93.2 |
2.5 |
0.485 |
3 |
0 |
0 |
0.000 |
10 |
13 |
|
[IMD]A:503 |
5 |
1 |
198 |
f |
A |
x,y,z |
1_555 |
22 |
7 |
18075 |
89.9 |
2.4 |
0.344 |
0 |
0 |
0 |
0.000 |
11 |
14 |
|
[IMD]B:504 |
5 |
1 |
199 |
f |
B |
x,y,z |
1_555 |
25 |
8 |
17992 |
89.4 |
2.2 |
0.361 |
0 |
0 |
0 |
0.000 |
12 |
15 |
|
[EDO]A:506 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
18075 |
76.0 |
1.4 |
0.247 |
1 |
0 |
0 |
0.000 |
13 |
16 |
|
[EDO]B:505 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
11 |
5 |
17992 |
73.5 |
1.4 |
0.243 |
1 |
0 |
0 |
0.000 |
14 |
17 |
|
[EDO]A:506 |
4 |
1 |
184 |
◊ |
B |
y,x,-z |
7_555 |
10 |
3 |
17992 |
59.0 |
1.7 |
0.304 |
1 |
0 |
0 |
0.000 |
15 |
18 |
|
[EDO]B:505 |
4 |
1 |
185 |
◊ |
A |
y,x,-z |
7_555 |
10 |
3 |
18075 |
58.1 |
1.5 |
0.842 |
1 |
0 |
0 |
0.000 |
16 |
19 |
|
[EDO]B:503 |
4 |
1 |
184 |
f |
[0MV]B:501 |
x,y,z |
1_555 |
6 |
1 |
484 |
50.7 |
1.2 |
0.955 |
1 |
0 |
0 |
0.000 |
17 |
20 |
|
[IMD]A:503 |
5 |
1 |
198 |
f |
[0MV]A:501 |
x,y,z |
1_555 |
10 |
1 |
483 |
49.9 |
0.5 |
0.112 |
0 |
0 |
0 |
0.000 |
18 |
21 |
|
[IMD]B:504 |
5 |
1 |
199 |
f |
[0MV]B:501 |
x,y,z |
1_555 |
10 |
1 |
484 |
49.6 |
0.5 |
0.111 |
0 |
0 |
0 |
0.000 |
19 |
22 |
|
[EDO]A:504 |
4 |
1 |
184 |
f |
[0MV]A:501 |
x,y,z |
1_555 |
7 |
1 |
483 |
48.2 |
1.4 |
0.957 |
0 |
0 |
0 |
0.000 |
20 |
23 |
|
[EDO]B:505 |
3 |
1 |
185 |
f |
B |
y,x,-z |
7_555 |
6 |
3 |
17992 |
44.5 |
0.8 |
0.219 |
0 |
0 |
0 |
0.000 |
21 |
24 |
|
[EDO]A:506 |
3 |
1 |
184 |
f |
A |
y,x,-z |
7_555 |
8 |
3 |
18075 |
42.6 |
0.7 |
0.662 |
0 |
0 |
0 |
0.000 |
22 |
25 |
|
[IMD]B:504 |
2 |
1 |
199 |
f |
[PIS]B:502 |
x,y,z |
1_555 |
1 |
1 |
282 |
19.9 |
-0.4 |
0.189 |
0 |
0 |
0 |
0.022 |
23 |
26 |
|
[IMD]A:503 |
3 |
1 |
198 |
f |
[PIS]A:502 |
x,y,z |
1_555 |
1 |
1 |
282 |
17.0 |
-0.6 |
0.084 |
0 |
0 |
0 |
0.033 |
24 |
27 |
|
[PIS]A:502 |
3 |
1 |
282 |
f |
[0MV]A:501 |
x,y,z |
1_555 |
6 |
1 |
483 |
14.2 |
-0.7 |
0.704 |
0 |
0 |
0 |
0.036 |
28 |
|
[PIS]B:502 |
3 |
1 |
282 |
f |
[0MV]B:501 |
x,y,z |
1_555 |
6 |
1 |
484 |
12.4 |
-0.6 |
0.696 |
0 |
0 |
0 |
0.036 |
Average: |
13.3 |
-0.7 |
0.700 |
0 |
0 |
0 |
0.036 |
25 |
29 |
|
[EDO]B:503 |
2 |
1 |
184 |
f |
[IMD]B:504 |
x,y,z |
1_555 |
2 |
1 |
199 |
9.0 |
0.4 |
0.346 |
0 |
0 |
0 |
0.000 |
26 |
30 |
|
[EDO]A:504 |
2 |
1 |
184 |
f |
[IMD]A:503 |
x,y,z |
1_555 |
2 |
1 |
198 |
7.0 |
0.4 |
0.346 |
0 |
0 |
0 |
0.000 |
|