## |
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 |
195 |
44 |
10538 |
◊ |
A |
x,y,z |
1_555 |
214 |
60 |
17834 |
1766.1 |
-13.0 |
0.290 |
31 |
9 |
0 |
0.476 |
2 |
|
D |
187 |
47 |
10617 |
◊ |
C |
x,y,z |
1_555 |
205 |
57 |
17979 |
1750.3 |
-10.6 |
0.304 |
32 |
9 |
0 |
0.476 |
3 |
|
F |
184 |
44 |
10582 |
◊ |
E |
x,y,z |
1_555 |
209 |
58 |
17857 |
1750.0 |
-13.5 |
0.213 |
28 |
8 |
0 |
0.476 |
Average: |
1755.5 |
-12.4 |
0.269 |
30 |
9 |
0 |
0.476 |
2 |
4 |
|
E |
176 |
44 |
17857 |
◊ |
C |
x,y,z |
1_555 |
176 |
43 |
17979 |
1629.6 |
-9.2 |
0.275 |
33 |
19 |
0 |
0.440 |
5 |
|
E |
174 |
43 |
17857 |
◊ |
A |
x,y,z |
1_555 |
177 |
44 |
17834 |
1612.6 |
-9.2 |
0.294 |
30 |
20 |
0 |
0.440 |
6 |
|
C |
169 |
43 |
17979 |
◊ |
A |
x,y,z |
1_555 |
166 |
40 |
17834 |
1594.1 |
-7.6 |
0.354 |
32 |
17 |
0 |
0.440 |
Average: |
1612.1 |
-8.7 |
0.308 |
32 |
19 |
0 |
0.440 |
3 |
7 |
|
F |
167 |
41 |
10582 |
◊ |
D |
x,y,z |
1_555 |
144 |
42 |
10617 |
1451.6 |
-13.0 |
0.162 |
23 |
9 |
0 |
1.000 |
8 |
|
F |
146 |
41 |
10582 |
◊ |
B |
x,y,z |
1_555 |
171 |
41 |
10538 |
1424.4 |
-12.4 |
0.199 |
25 |
9 |
0 |
1.000 |
9 |
|
D |
168 |
41 |
10617 |
◊ |
B |
x,y,z |
1_555 |
150 |
42 |
10538 |
1422.6 |
-11.8 |
0.219 |
25 |
9 |
0 |
1.000 |
Average: |
1432.9 |
-12.4 |
0.193 |
24 |
9 |
0 |
1.000 |
4 |
10 |
|
C |
75 |
24 |
17979 |
◊ |
A |
-y+1/2,x+1/2,z-1/4 |
3_554 |
79 |
23 |
17834 |
617.4 |
1.1 |
0.737 |
9 |
2 |
0 |
0.000 |
5 |
11 |
|
E |
38 |
15 |
17857 |
◊ |
D |
-x+1/2,y-1/2,-z+3/4 |
5_545 |
40 |
12 |
10617 |
328.8 |
-0.3 |
0.632 |
3 |
0 |
0 |
0.000 |
6 |
12 |
|
B |
34 |
7 |
10538 |
◊ |
E |
x,y,z |
1_555 |
39 |
12 |
17857 |
316.8 |
0.8 |
0.660 |
8 |
6 |
0 |
0.031 |
13 |
|
D |
31 |
7 |
10617 |
◊ |
A |
x,y,z |
1_555 |
41 |
14 |
17834 |
314.5 |
0.6 |
0.628 |
7 |
5 |
0 |
0.031 |
14 |
|
F |
35 |
8 |
10582 |
◊ |
C |
x,y,z |
1_555 |
40 |
12 |
17979 |
311.6 |
1.1 |
0.683 |
8 |
7 |
0 |
0.031 |
Average: |
314.3 |
0.8 |
0.657 |
8 |
6 |
0 |
0.031 |
7 |
15 |
|
E |
41 |
11 |
17857 |
◊ |
E |
-y,-x,-z+1/2 |
8_555 |
41 |
11 |
17857 |
311.9 |
-0.8 |
0.555 |
0 |
0 |
0 |
0.000 |
8 |
16 |
|
[BNL]A:601 |
12 |
1 |
329 |
f |
A |
x,y,z |
1_555 |
38 |
17 |
17834 |
210.9 |
-0.6 |
0.135 |
0 |
0 |
0 |
0.011 |
9 |
17 |
|
[BNL]C:1001 |
12 |
1 |
326 |
f |
C |
x,y,z |
1_555 |
39 |
18 |
17979 |
209.1 |
-0.4 |
0.160 |
0 |
0 |
0 |
0.007 |
10 |
18 |
|
[BNL]E:2001 |
12 |
1 |
330 |
f |
E |
x,y,z |
1_555 |
33 |
17 |
17857 |
208.9 |
0.3 |
0.212 |
0 |
0 |
0 |
0.000 |
11 |
19 |
|
B |
14 |
3 |
10538 |
◊ |
B |
y,x,-z+1 |
7_556 |
14 |
3 |
10538 |
127.8 |
-0.1 |
0.642 |
0 |
0 |
0 |
0.000 |
12 |
20 |
|
[FES]C:500 |
4 |
1 |
234 |
f |
C |
x,y,z |
1_555 |
19 |
8 |
17979 |
114.9 |
-15.1 |
0.613 |
2 |
0 |
0 |
0.285 |
21 |
|
[FES]A:500 |
4 |
1 |
236 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
17834 |
114.7 |
-15.3 |
0.618 |
2 |
0 |
0 |
0.285 |
22 |
|
[FES]E:500 |
4 |
1 |
234 |
f |
E |
x,y,z |
1_555 |
17 |
8 |
17857 |
112.9 |
-15.1 |
0.608 |
3 |
0 |
0 |
0.285 |
Average: |
114.2 |
-15.1 |
0.613 |
2 |
0 |
0 |
0.285 |
13 |
23 |
|
C |
9 |
5 |
17979 |
◊ |
E |
-y,-x+1,-z+1/2 |
8_565 |
9 |
3 |
17857 |
77.6 |
-0.9 |
0.379 |
0 |
0 |
0 |
0.000 |
14 |
24 |
|
[FE2]C:600 |
1 |
1 |
137 |
f |
C |
x,y,z |
1_555 |
9 |
6 |
17979 |
58.3 |
-11.7 |
0.000 |
0 |
0 |
0 |
0.204 |
25 |
|
[FE2]E:600 |
1 |
1 |
137 |
f |
E |
x,y,z |
1_555 |
6 |
6 |
17857 |
57.9 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.204 |
26 |
|
[FE2]A:600 |
1 |
1 |
137 |
cf |
A |
x,y,z |
1_555 |
8 |
5 |
17834 |
56.9 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.204 |
Average: |
57.7 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.204 |
15 |
27 |
|
E |
8 |
4 |
17857 |
◊ |
A |
-y,-x,-z+1/2 |
8_555 |
5 |
3 |
17834 |
43.4 |
1.1 |
0.743 |
1 |
1 |
0 |
0.000 |
16 |
28 |
|
F |
5 |
1 |
10582 |
◊ |
D |
-x+1/2,y-1/2,-z+3/4 |
5_545 |
4 |
1 |
10617 |
40.3 |
-0.9 |
0.280 |
0 |
0 |
0 |
0.000 |
17 |
29 |
|
[BNL]C:1001 |
5 |
1 |
326 |
f |
[FE2]C:600 |
x,y,z |
1_555 |
1 |
1 |
137 |
32.0 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.053 |
18 |
30 |
|
[BNL]E:2001 |
6 |
1 |
330 |
f |
[FE2]E:600 |
x,y,z |
1_555 |
1 |
1 |
137 |
28.5 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.049 |
19 |
31 |
|
[BNL]A:601 |
8 |
1 |
329 |
f |
[FE2]A:600 |
x,y,z |
1_555 |
1 |
1 |
137 |
28.3 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.045 |
20 |
32 |
|
[FES]E:500 |
3 |
1 |
234 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
17834 |
21.0 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.026 |
33 |
|
[FES]C:500 |
3 |
1 |
234 |
◊ |
E |
x,y,z |
1_555 |
4 |
2 |
17857 |
20.6 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.026 |
34 |
|
[FES]A:500 |
3 |
1 |
236 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
17979 |
19.6 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.026 |
Average: |
20.4 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.026 |
21 |
35 |
|
B |
2 |
1 |
10538 |
◊ |
C |
-x+1/2,y-1/2,-z+3/4 |
5_545 |
2 |
1 |
17979 |
5.5 |
0.2 |
0.735 |
0 |
0 |
0 |
0.000 |
22 |
36 |
|
[FE2]A:600 |
1 |
1 |
137 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
17857 |
3.6 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.004 |
37 |
|
[FE2]E:600 |
1 |
1 |
137 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
17979 |
2.5 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.004 |
38 |
|
[FE2]C:600 |
1 |
1 |
137 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
17834 |
1.0 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.004 |
Average: |
2.4 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.004 |
|