| ## |
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 |
197 |
56 |
13970 |
◊ |
A |
x,y,z |
1_555 |
190 |
54 |
13916 |
1901.9 |
-19.2 |
0.105 |
30 |
17 |
0 |
0.533 |
| 2 |
2 |
|
B |
112 |
36 |
13970 |
◊ |
A |
y-1,x,-z |
4_455 |
118 |
38 |
13916 |
1106.0 |
-9.3 |
0.215 |
10 |
0 |
0 |
0.259 |
| 3 |
3 |
|
A |
84 |
29 |
13916 |
◊ |
B |
-y,x-y+1,z-1/3 |
2_564 |
80 |
21 |
13970 |
721.3 |
-6.2 |
0.295 |
7 |
4 |
0 |
0.185 |
| 4 |
4 |
|
[NAP]A:402 |
44 |
1 |
888 |
f |
A |
x,y,z |
1_555 |
85 |
32 |
13916 |
609.4 |
-2.6 |
0.584 |
15 |
0 |
0 |
0.327 |
5 |
|
[NAP]B:402 |
46 |
1 |
895 |
f |
B |
x,y,z |
1_555 |
83 |
32 |
13970 |
607.1 |
-1.5 |
0.669 |
15 |
0 |
0 |
0.327 |
| Average: |
608.2 |
-2.1 |
0.626 |
15 |
0 |
0 |
0.327 |
| 5 |
6 |
|
B |
30 |
10 |
13970 |
x |
B |
-y,x-y+1,z-1/3 |
2_564 |
38 |
11 |
13970 |
286.1 |
-0.7 |
0.622 |
3 |
4 |
0 |
0.000 |
| 6 |
7 |
|
[CXS]B:410 |
13 |
1 |
404 |
f |
B |
x,y,z |
1_555 |
24 |
9 |
13970 |
190.6 |
6.0 |
0.185 |
0 |
0 |
0 |
0.000 |
| 7 |
8 |
|
[HSE]B:409 |
8 |
1 |
254 |
f |
B |
x,y,z |
1_555 |
21 |
15 |
13970 |
148.2 |
4.3 |
0.514 |
9 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[HSE]A:412 |
8 |
1 |
255 |
f |
A |
x,y,z |
1_555 |
23 |
16 |
13916 |
147.8 |
4.0 |
0.511 |
8 |
0 |
0 |
0.000 |
| 9 |
10 |
|
[GOL]B:411 |
6 |
1 |
222 |
f |
B |
x,y,z |
1_555 |
25 |
11 |
13970 |
141.0 |
-0.7 |
0.550 |
6 |
0 |
0 |
0.062 |
| 10 |
11 |
|
[GOL]A:413 |
6 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
24 |
10 |
13916 |
126.9 |
0.3 |
0.604 |
5 |
0 |
0 |
0.036 |
| 11 |
12 |
|
B |
17 |
4 |
13970 |
◊ |
B |
x-y,-y,-z+1/3 |
5_555 |
17 |
4 |
13970 |
126.5 |
-1.9 |
0.338 |
0 |
0 |
0 |
0.018 |
| 12 |
13 |
|
B |
16 |
5 |
13970 |
◊ |
[NAP]A:402 |
y-1,x,-z |
4_455 |
8 |
1 |
888 |
90.6 |
1.7 |
0.698 |
1 |
0 |
0 |
0.000 |
14 |
|
[NAP]B:402 |
7 |
1 |
895 |
◊ |
A |
y-1,x,-z |
4_455 |
13 |
6 |
13916 |
75.5 |
1.3 |
0.719 |
1 |
0 |
0 |
0.000 |
| Average: |
83.0 |
1.5 |
0.708 |
1 |
0 |
0 |
0.000 |
| 13 |
15 |
|
[FMT]B:406 |
3 |
1 |
151 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
13970 |
86.5 |
-0.2 |
0.392 |
2 |
0 |
0 |
0.021 |
| 14 |
16 |
|
[FMT]B:403 |
3 |
1 |
149 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
13970 |
82.3 |
0.1 |
0.410 |
3 |
0 |
0 |
0.024 |
| 15 |
17 |
|
[FMT]A:403 |
3 |
1 |
149 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
13916 |
82.1 |
0.0 |
0.404 |
3 |
0 |
0 |
0.024 |
| 16 |
18 |
|
[FMT]B:408 |
3 |
1 |
151 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
13970 |
79.9 |
-0.4 |
0.346 |
1 |
0 |
0 |
0.016 |
| 17 |
19 |
|
[FMT]A:405 |
3 |
1 |
151 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
13916 |
79.4 |
-0.2 |
0.363 |
1 |
0 |
0 |
0.012 |
| 18 |
20 |
|
[FMT]B:407 |
3 |
1 |
149 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
13970 |
78.5 |
0.2 |
0.633 |
2 |
0 |
0 |
0.013 |
| 19 |
21 |
|
[FMT]A:409 |
3 |
1 |
149 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
13916 |
75.9 |
0.1 |
0.619 |
3 |
0 |
0 |
0.023 |
| 20 |
22 |
|
B |
11 |
6 |
13970 |
f |
[FMT]A:404 |
y-1,x,-z |
4_455 |
3 |
1 |
150 |
75.2 |
-0.8 |
0.274 |
1 |
0 |
0 |
0.023 |
| 21 |
23 |
|
[FMT]A:406 |
3 |
1 |
149 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
13916 |
75.0 |
-0.8 |
0.257 |
1 |
0 |
0 |
0.023 |
| 22 |
24 |
|
[FMT]B:405 |
3 |
1 |
151 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
13970 |
74.2 |
0.6 |
0.678 |
1 |
0 |
0 |
0.000 |
| 23 |
25 |
|
[FMT]A:410 |
3 |
1 |
152 |
◊ |
B |
x,y,z |
1_555 |
15 |
6 |
13970 |
72.6 |
-0.1 |
0.416 |
1 |
0 |
0 |
0.008 |
| 24 |
26 |
|
[FMT]B:404 |
3 |
1 |
150 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
13916 |
70.9 |
0.1 |
0.450 |
1 |
0 |
0 |
0.005 |
| 25 |
27 |
|
[FMT]A:407 |
3 |
1 |
150 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
13916 |
60.8 |
-0.3 |
0.364 |
2 |
0 |
0 |
0.023 |
| 26 |
28 |
|
[FMT]A:408 |
3 |
1 |
149 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
13916 |
58.0 |
-0.7 |
0.362 |
0 |
0 |
0 |
0.013 |
| 27 |
29 |
|
[FMT]A:410 |
3 |
1 |
152 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
13916 |
55.2 |
-0.3 |
0.523 |
1 |
0 |
0 |
0.014 |
| 28 |
30 |
|
B |
7 |
3 |
13970 |
◊ |
[FMT]A:411 |
y-1,x,-z |
4_455 |
3 |
1 |
152 |
55.1 |
-0.3 |
0.423 |
0 |
0 |
0 |
0.005 |
| 29 |
31 |
|
[FMT]A:411 |
3 |
1 |
152 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
13916 |
54.8 |
-0.5 |
0.404 |
1 |
0 |
0 |
0.017 |
| 30 |
32 |
|
[FMT]A:408 |
3 |
1 |
149 |
◊ |
B |
-y,x-y+1,z-1/3 |
2_564 |
8 |
3 |
13970 |
54.6 |
-0.3 |
0.353 |
0 |
0 |
0 |
0.005 |
| 31 |
33 |
|
[FMT]A:407 |
3 |
1 |
150 |
◊ |
B |
-y,x-y+1,z-1/3 |
2_564 |
12 |
5 |
13970 |
51.7 |
-0.8 |
0.385 |
0 |
0 |
0 |
0.014 |
| 32 |
34 |
|
[FMT]B:404 |
3 |
1 |
150 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
13970 |
50.0 |
0.5 |
0.690 |
2 |
0 |
0 |
0.008 |
| 33 |
35 |
|
[HSE]A:412 |
3 |
1 |
255 |
f |
[NAP]A:402 |
x,y,z |
1_555 |
9 |
1 |
888 |
46.6 |
0.9 |
0.498 |
0 |
0 |
0 |
0.000 |
| 34 |
36 |
|
[GOL]A:413 |
3 |
1 |
222 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
13970 |
42.6 |
0.1 |
0.620 |
1 |
0 |
0 |
0.005 |
| 35 |
37 |
|
[HSE]B:409 |
2 |
1 |
254 |
f |
[NAP]B:402 |
x,y,z |
1_555 |
9 |
1 |
895 |
40.9 |
0.8 |
0.578 |
0 |
0 |
0 |
0.000 |
| 36 |
38 |
|
B |
3 |
1 |
13970 |
◊ |
[FMT]A:406 |
y-1,x,-z |
4_455 |
3 |
1 |
149 |
38.6 |
0.7 |
0.778 |
1 |
0 |
0 |
0.000 |
| 37 |
39 |
|
[FMT]A:404 |
3 |
1 |
150 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
13916 |
37.7 |
0.7 |
0.775 |
2 |
0 |
0 |
0.004 |
| 38 |
40 |
|
[GOL]A:413 |
3 |
1 |
222 |
◊ |
[FMT]B:404 |
x,y,z |
1_555 |
1 |
1 |
150 |
17.4 |
0.1 |
0.403 |
0 |
0 |
0 |
0.000 |
| 39 |
41 |
|
[FMT]A:411 |
2 |
1 |
152 |
f |
[FMT]A:406 |
x,y,z |
1_555 |
2 |
1 |
149 |
11.3 |
0.0 |
0.556 |
0 |
0 |
0 |
0.000 |
| 40 |
42 |
|
A |
1 |
1 |
13916 |
x |
A |
-y,x-y+1,z-1/3 |
2_564 |
2 |
1 |
13916 |
8.8 |
0.1 |
0.678 |
0 |
0 |
0 |
0.000 |
| 41 |
43 |
|
[NA]A:401 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
13970 |
8.5 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.034 |
44 |
|
[NA]B:401 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
13916 |
7.5 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.034 |
| Average: |
8.0 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.034 |
| 42 |
45 |
|
[FMT]B:406 |
2 |
1 |
151 |
◊ |
B |
-y,x-y+1,z-1/3 |
2_564 |
2 |
1 |
13970 |
7.9 |
-0.0 |
0.570 |
0 |
0 |
0 |
0.000 |
|