## |
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 |
|
N |
270 |
74 |
13020 |
◊ |
M |
x,y,z |
1_555 |
271 |
76 |
22077 |
2596.3 |
-19.9 |
0.170 |
37 |
10 |
0 |
0.333 |
2 |
|
B |
250 |
69 |
12978 |
◊ |
A |
x,y,z |
1_555 |
266 |
79 |
22175 |
2556.0 |
-16.2 |
0.232 |
42 |
13 |
0 |
0.333 |
Average: |
2576.1 |
-18.1 |
0.201 |
40 |
12 |
0 |
0.333 |
2 |
3 |
|
D |
219 |
59 |
9041 |
◊ |
C |
x,y,z |
1_555 |
214 |
58 |
11291 |
2351.8 |
-48.5 |
0.542 |
14 |
6 |
0 |
1.000 |
4 |
|
P |
217 |
61 |
8954 |
◊ |
O |
x,y,z |
1_555 |
213 |
57 |
11411 |
2320.3 |
-48.2 |
0.583 |
13 |
5 |
0 |
1.000 |
Average: |
2336.1 |
-48.4 |
0.562 |
14 |
6 |
0 |
1.000 |
3 |
5 |
|
O |
126 |
27 |
11411 |
◊ |
N |
x,y,z |
1_555 |
160 |
49 |
13020 |
1356.7 |
-12.7 |
0.602 |
15 |
4 |
0 |
0.257 |
6 |
|
C |
131 |
27 |
11291 |
◊ |
B |
x,y,z |
1_555 |
156 |
46 |
12978 |
1342.6 |
-10.4 |
0.648 |
20 |
3 |
0 |
0.257 |
Average: |
1349.6 |
-11.6 |
0.625 |
18 |
4 |
0 |
0.257 |
4 |
7 |
|
D |
89 |
20 |
9041 |
◊ |
B |
x,y,z |
1_555 |
97 |
26 |
12978 |
883.7 |
-10.1 |
0.598 |
7 |
3 |
0 |
0.191 |
8 |
|
P |
88 |
19 |
8954 |
◊ |
N |
x,y,z |
1_555 |
93 |
25 |
13020 |
828.5 |
-10.5 |
0.501 |
4 |
3 |
0 |
0.191 |
Average: |
856.1 |
-10.3 |
0.549 |
6 |
3 |
0 |
0.191 |
5 |
9 |
|
[FAD]M:601 |
53 |
1 |
991 |
f |
M |
x,y,z |
1_555 |
101 |
41 |
22077 |
689.9 |
-8.5 |
0.371 |
23 |
0 |
0 |
0.172 |
10 |
|
[FAD]A:601 |
53 |
1 |
999 |
f |
A |
x,y,z |
1_555 |
106 |
42 |
22175 |
689.2 |
-8.5 |
0.358 |
24 |
0 |
0 |
0.172 |
Average: |
689.6 |
-8.5 |
0.364 |
24 |
0 |
0 |
0.172 |
6 |
11 |
|
A |
62 |
19 |
22175 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
60 |
20 |
22175 |
570.7 |
-2.1 |
0.378 |
5 |
0 |
0 |
0.000 |
7 |
12 |
|
M |
66 |
16 |
22077 |
◊ |
A |
x,y-1,z |
1_545 |
62 |
18 |
22175 |
539.5 |
-0.9 |
0.527 |
3 |
2 |
0 |
0.000 |
8 |
13 |
|
P |
36 |
14 |
8954 |
◊ |
D |
x,y,z |
1_555 |
37 |
15 |
9041 |
368.2 |
-9.3 |
0.502 |
0 |
0 |
0 |
0.059 |
9 |
14 |
|
O |
38 |
13 |
11411 |
◊ |
C |
-x+1,y-1/2,-z-1/2 |
3_644 |
39 |
7 |
11291 |
335.3 |
-5.8 |
0.728 |
2 |
0 |
0 |
0.054 |
10 |
15 |
|
P |
23 |
8 |
8954 |
◊ |
C |
-x+1,y-1/2,-z-1/2 |
3_644 |
25 |
8 |
11291 |
218.0 |
-5.3 |
0.557 |
0 |
0 |
0 |
0.043 |
11 |
16 |
|
P |
24 |
5 |
8954 |
◊ |
B |
x,y,z |
1_555 |
23 |
6 |
12978 |
210.7 |
-2.3 |
0.531 |
1 |
0 |
0 |
0.032 |
17 |
|
D |
26 |
6 |
9041 |
◊ |
N |
x,y,z |
1_555 |
20 |
5 |
13020 |
189.2 |
-1.8 |
0.473 |
1 |
0 |
0 |
0.032 |
Average: |
200.0 |
-2.1 |
0.502 |
1 |
0 |
0 |
0.032 |
12 |
18 |
|
C |
20 |
4 |
11291 |
◊ |
A |
x,y,z |
1_555 |
17 |
6 |
22175 |
182.4 |
-1.0 |
0.562 |
1 |
3 |
0 |
0.014 |
19 |
|
O |
19 |
4 |
11411 |
◊ |
M |
x,y,z |
1_555 |
16 |
5 |
22077 |
162.2 |
-0.9 |
0.423 |
1 |
3 |
0 |
0.014 |
Average: |
172.3 |
-1.0 |
0.492 |
1 |
3 |
0 |
0.014 |
13 |
20 |
|
[SF4]B:246 |
8 |
1 |
296 |
cf |
B |
x,y,z |
1_555 |
22 |
12 |
12978 |
169.7 |
-20.4 |
0.467 |
1 |
0 |
0 |
0.291 |
14 |
21 |
|
[F3S]N:245 |
7 |
1 |
302 |
f |
N |
x,y,z |
1_555 |
24 |
14 |
13020 |
169.6 |
-18.2 |
0.603 |
4 |
0 |
0 |
0.284 |
22 |
|
[F3S]B:245 |
7 |
1 |
303 |
cf |
B |
x,y,z |
1_555 |
20 |
13 |
12978 |
164.9 |
-18.2 |
0.387 |
4 |
0 |
0 |
0.284 |
Average: |
167.2 |
-18.2 |
0.495 |
4 |
0 |
0 |
0.284 |
15 |
23 |
|
[SF4]N:246 |
8 |
1 |
290 |
cf |
N |
x,y,z |
1_555 |
21 |
13 |
13020 |
162.9 |
-19.7 |
0.388 |
0 |
0 |
0 |
0.280 |
16 |
24 |
|
[GUA]M:577 |
9 |
1 |
272 |
f |
M |
x,y,z |
1_555 |
27 |
14 |
22077 |
152.3 |
2.4 |
0.370 |
4 |
0 |
0 |
0.000 |
17 |
25 |
|
[GUA]A:577 |
9 |
1 |
273 |
f |
A |
x,y,z |
1_555 |
28 |
14 |
22175 |
150.6 |
3.7 |
0.512 |
5 |
0 |
0 |
0.000 |
18 |
26 |
|
[FES]N:244 |
4 |
1 |
235 |
f |
N |
x,y,z |
1_555 |
18 |
12 |
13020 |
125.7 |
-17.1 |
0.623 |
2 |
0 |
0 |
0.255 |
27 |
|
[FES]B:244 |
4 |
1 |
234 |
f |
B |
x,y,z |
1_555 |
15 |
11 |
12978 |
122.6 |
-16.7 |
0.652 |
1 |
0 |
0 |
0.255 |
Average: |
124.2 |
-16.9 |
0.637 |
2 |
0 |
0 |
0.255 |
19 |
28 |
|
[GUA]A:577 |
6 |
1 |
273 |
f |
[FAD]A:601 |
x,y,z |
1_555 |
14 |
1 |
999 |
59.9 |
1.5 |
0.309 |
0 |
0 |
0 |
0.000 |
20 |
29 |
|
[GUA]M:577 |
6 |
1 |
272 |
f |
[FAD]M:601 |
x,y,z |
1_555 |
14 |
1 |
991 |
55.4 |
1.2 |
0.263 |
0 |
0 |
0 |
0.000 |
21 |
30 |
|
O |
3 |
1 |
11411 |
◊ |
D |
-x+1,y-1/2,-z-1/2 |
3_644 |
5 |
2 |
9041 |
45.3 |
-1.2 |
0.381 |
0 |
0 |
0 |
0.009 |
22 |
31 |
|
A |
3 |
1 |
22175 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
5 |
2 |
12978 |
31.7 |
0.5 |
0.801 |
1 |
0 |
0 |
0.000 |
23 |
32 |
|
M |
3 |
1 |
22077 |
◊ |
N |
x-1/2,-y-1/2,-z |
4_445 |
3 |
2 |
13020 |
17.4 |
0.1 |
0.642 |
0 |
0 |
0 |
0.000 |
24 |
33 |
|
[FAD]M:601 |
1 |
1 |
991 |
◊ |
N |
x,y,z |
1_555 |
2 |
1 |
13020 |
15.3 |
-0.8 |
0.151 |
0 |
0 |
0 |
0.007 |
34 |
|
[FAD]A:601 |
1 |
1 |
999 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
12978 |
15.0 |
-0.7 |
0.208 |
0 |
0 |
0 |
0.007 |
Average: |
15.1 |
-0.8 |
0.179 |
0 |
0 |
0 |
0.007 |
25 |
35 |
|
M |
3 |
2 |
22077 |
x |
M |
x-1/2,-y-1/2,-z |
4_445 |
2 |
2 |
22077 |
7.0 |
0.3 |
0.765 |
0 |
0 |
0 |
0.000 |
26 |
36 |
|
[FES]N:244 |
1 |
1 |
235 |
◊ |
M |
x,y,z |
1_555 |
1 |
1 |
22077 |
2.6 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.003 |
37 |
|
[FES]B:244 |
2 |
1 |
234 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
22175 |
1.1 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.003 |
Average: |
1.9 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.003 |
|