## |
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 |
|
D |
174 |
40 |
12256 |
◊ |
C |
x,y,z |
1_555 |
170 |
41 |
12983 |
1575.0 |
-26.1 |
0.012 |
4 |
4 |
0 |
1.000 |
2 |
|
B |
179 |
43 |
13338 |
◊ |
A |
x,y,z |
1_555 |
173 |
41 |
12432 |
1563.2 |
-25.5 |
0.014 |
4 |
4 |
0 |
1.000 |
Average: |
1569.1 |
-25.8 |
0.013 |
4 |
4 |
0 |
1.000 |
2 |
3 |
|
C |
84 |
25 |
12983 |
◊ |
B |
x,y,z |
1_555 |
84 |
24 |
13338 |
836.6 |
-4.1 |
0.548 |
11 |
12 |
0 |
0.314 |
4 |
|
D |
84 |
25 |
12256 |
◊ |
A |
x,y,z |
1_555 |
85 |
25 |
12432 |
836.0 |
-5.8 |
0.414 |
11 |
12 |
0 |
0.314 |
Average: |
836.3 |
-5.0 |
0.481 |
11 |
12 |
0 |
0.314 |
3 |
5 |
|
C |
88 |
21 |
12983 |
◊ |
B |
-x+1/2,y-1/2,-z+2 |
4_547 |
90 |
18 |
13338 |
759.5 |
-3.4 |
0.595 |
1 |
2 |
0 |
0.000 |
4 |
6 |
|
B |
86 |
22 |
13338 |
◊ |
A |
x,y,z-1 |
1_554 |
76 |
19 |
12432 |
685.8 |
-5.7 |
0.364 |
2 |
0 |
0 |
0.000 |
5 |
7 |
|
B |
40 |
13 |
13338 |
◊ |
A |
-x,y,-z+2 |
2_557 |
40 |
12 |
12432 |
360.5 |
3.4 |
0.905 |
3 |
7 |
0 |
0.000 |
6 |
8 |
|
D |
23 |
9 |
12256 |
◊ |
D |
-x+1,y,-z+3 |
2_658 |
23 |
9 |
12256 |
177.8 |
0.5 |
0.729 |
2 |
8 |
0 |
0.000 |
7 |
9 |
|
[GOL]A:402 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
17 |
10 |
12432 |
126.7 |
-0.8 |
0.496 |
2 |
0 |
0 |
0.169 |
10 |
|
[GOL]C:402 |
6 |
1 |
218 |
f |
C |
x,y,z |
1_555 |
18 |
10 |
12983 |
126.7 |
-0.7 |
0.533 |
2 |
0 |
0 |
0.169 |
11 |
|
[GOL]D:404 |
6 |
1 |
217 |
f |
D |
x,y,z |
1_555 |
18 |
10 |
12256 |
125.8 |
-0.7 |
0.546 |
1 |
0 |
0 |
0.169 |
Average: |
126.4 |
-0.7 |
0.525 |
2 |
0 |
0 |
0.169 |
8 |
12 |
|
[GOL]B:403 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
17 |
10 |
13338 |
125.8 |
-0.8 |
0.505 |
1 |
0 |
0 |
0.045 |
9 |
13 |
|
[PYR]C:401 |
5 |
1 |
205 |
cf |
C |
x,y,z |
1_555 |
17 |
11 |
12983 |
122.3 |
5.0 |
0.572 |
3 |
0 |
0 |
0.000 |
14 |
|
[PYR]A:401 |
5 |
1 |
205 |
cf |
A |
x,y,z |
1_555 |
18 |
10 |
12432 |
117.4 |
4.9 |
0.570 |
3 |
0 |
0 |
0.000 |
Average: |
119.8 |
5.0 |
0.571 |
3 |
0 |
0 |
0.000 |
10 |
15 |
|
[PYR]B:401 |
5 |
1 |
205 |
cf |
B |
x,y,z |
1_555 |
17 |
11 |
13338 |
119.8 |
4.9 |
0.562 |
3 |
0 |
0 |
0.000 |
11 |
16 |
|
[PYR]D:401 |
5 |
1 |
206 |
cf |
D |
x,y,z |
1_555 |
18 |
11 |
12256 |
118.6 |
5.0 |
0.570 |
3 |
0 |
0 |
0.000 |
12 |
17 |
|
[GOL]A:403 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
12432 |
110.5 |
-0.9 |
0.441 |
0 |
0 |
0 |
0.094 |
13 |
18 |
|
[GOL]B:402 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
21 |
11 |
13338 |
109.2 |
-0.5 |
0.515 |
0 |
0 |
0 |
0.019 |
14 |
19 |
|
[GOL]A:405 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
22 |
11 |
12432 |
105.7 |
-0.4 |
0.577 |
1 |
0 |
0 |
0.089 |
15 |
20 |
|
[GOL]A:407 |
5 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
12432 |
102.6 |
-0.3 |
0.479 |
0 |
0 |
0 |
0.028 |
16 |
21 |
|
[GOL]D:403 |
6 |
1 |
219 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
12256 |
98.9 |
0.6 |
0.681 |
2 |
0 |
0 |
0.013 |
17 |
22 |
|
[GOL]A:404 |
5 |
1 |
220 |
f |
D |
x,y,z |
1_555 |
16 |
7 |
12256 |
92.9 |
-0.2 |
0.566 |
0 |
0 |
0 |
0.009 |
18 |
23 |
|
[GOL]B:404 |
5 |
1 |
220 |
f |
C |
x,y,z |
1_555 |
16 |
7 |
12983 |
92.4 |
-0.3 |
0.589 |
0 |
0 |
0 |
0.011 |
19 |
24 |
|
[GOL]D:402 |
5 |
1 |
214 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
12432 |
90.8 |
-0.4 |
0.561 |
0 |
0 |
0 |
0.036 |
20 |
25 |
|
[FMT]C:403 |
3 |
1 |
149 |
◊ |
C |
x,y,z |
1_555 |
11 |
7 |
12983 |
82.3 |
0.0 |
0.436 |
0 |
0 |
0 |
0.000 |
21 |
26 |
|
[FMT]B:405 |
3 |
1 |
149 |
f |
B |
x,y,z |
1_555 |
12 |
8 |
13338 |
81.3 |
0.0 |
0.434 |
2 |
0 |
0 |
0.030 |
22 |
27 |
|
[FMT]A:406 |
3 |
1 |
149 |
◊ |
A |
x,y,z |
1_555 |
11 |
7 |
12432 |
80.0 |
0.3 |
0.446 |
0 |
0 |
0 |
0.000 |
23 |
28 |
|
[FMT]D:405 |
3 |
1 |
148 |
f |
D |
x,y,z |
1_555 |
11 |
7 |
12256 |
79.9 |
0.2 |
0.447 |
2 |
0 |
0 |
0.026 |
24 |
29 |
|
[GOL]D:402 |
5 |
1 |
214 |
◊ |
D |
x,y,z |
1_555 |
7 |
2 |
12256 |
75.6 |
1.4 |
0.842 |
1 |
0 |
0 |
0.000 |
25 |
30 |
|
[GOL]B:404 |
5 |
1 |
220 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
13338 |
70.3 |
1.1 |
0.751 |
1 |
0 |
0 |
0.000 |
26 |
31 |
|
[GOL]A:404 |
5 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
8 |
2 |
12432 |
68.2 |
1.1 |
0.753 |
1 |
0 |
0 |
0.000 |
27 |
32 |
|
B |
6 |
3 |
13338 |
◊ |
B |
-x,y,-z+2 |
2_557 |
6 |
3 |
13338 |
59.2 |
2.5 |
0.940 |
1 |
2 |
0 |
0.000 |
33 |
|
A |
3 |
2 |
12432 |
◊ |
A |
-x,y,-z+2 |
2_557 |
3 |
2 |
12432 |
26.4 |
1.3 |
0.933 |
0 |
0 |
0 |
0.000 |
Average: |
42.8 |
1.9 |
0.937 |
1 |
1 |
0 |
0.000 |
28 |
34 |
|
B |
11 |
5 |
13338 |
◊ |
[GOL]A:405 |
x,y,z-1 |
1_554 |
5 |
1 |
217 |
54.2 |
0.1 |
0.626 |
0 |
0 |
0 |
0.000 |
29 |
35 |
|
B |
8 |
4 |
13338 |
◊ |
D |
-x+1/2,y-1/2,-z+2 |
4_547 |
4 |
3 |
12256 |
54.1 |
0.2 |
0.698 |
0 |
0 |
0 |
0.000 |
30 |
36 |
|
[GOL]B:402 |
5 |
1 |
219 |
◊ |
A |
x,y,z-1 |
1_554 |
10 |
5 |
12432 |
54.0 |
0.2 |
0.624 |
0 |
0 |
0 |
0.000 |
31 |
37 |
|
C |
5 |
1 |
12983 |
◊ |
C |
-x+1,y,-z+3 |
2_658 |
5 |
1 |
12983 |
44.6 |
1.4 |
0.906 |
0 |
0 |
0 |
0.000 |
32 |
38 |
|
[GOL]A:407 |
4 |
1 |
221 |
f |
[GOL]A:402 |
x,y,z |
1_555 |
4 |
1 |
217 |
43.8 |
-0.4 |
0.436 |
0 |
0 |
0 |
0.044 |
33 |
39 |
|
[GOL]D:404 |
4 |
1 |
217 |
f |
[GOL]D:403 |
x,y,z |
1_555 |
4 |
1 |
219 |
40.9 |
-0.3 |
0.540 |
0 |
0 |
0 |
0.013 |
34 |
40 |
|
[FMT]A:406 |
3 |
1 |
149 |
f |
B |
x,y,z |
1_555 |
3 |
2 |
13338 |
29.3 |
-0.6 |
0.211 |
0 |
0 |
0 |
0.022 |
35 |
41 |
|
[FMT]B:405 |
3 |
1 |
149 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
12432 |
29.1 |
-0.6 |
0.216 |
0 |
0 |
0 |
0.022 |
36 |
42 |
|
[FMT]C:403 |
3 |
1 |
149 |
f |
D |
x,y,z |
1_555 |
3 |
2 |
12256 |
28.6 |
-0.5 |
0.219 |
0 |
0 |
0 |
0.018 |
37 |
43 |
|
B |
2 |
2 |
13338 |
◊ |
[GOL]A:403 |
x,y,z-1 |
1_554 |
2 |
1 |
219 |
28.6 |
-0.3 |
0.322 |
0 |
0 |
0 |
0.000 |
38 |
44 |
|
[GOL]B:402 |
3 |
1 |
219 |
◊ |
[GOL]A:405 |
x,y,z-1 |
1_554 |
3 |
1 |
217 |
28.4 |
0.0 |
0.517 |
0 |
0 |
0 |
0.000 |
39 |
45 |
|
[FMT]D:405 |
3 |
1 |
148 |
◊ |
C |
x,y,z |
1_555 |
2 |
2 |
12983 |
27.0 |
-0.5 |
0.186 |
0 |
0 |
0 |
0.019 |
40 |
46 |
|
C |
1 |
1 |
12983 |
◊ |
D |
-x+1/2,y-1/2,-z+2 |
4_547 |
3 |
2 |
12256 |
22.6 |
-0.1 |
0.292 |
0 |
0 |
0 |
0.000 |
41 |
47 |
|
[FMT]B:405 |
1 |
1 |
149 |
f |
[PYR]B:401 |
x,y,z |
1_555 |
5 |
1 |
205 |
18.3 |
0.6 |
0.577 |
0 |
0 |
0 |
0.000 |
42 |
48 |
|
[FMT]D:405 |
1 |
1 |
148 |
f |
[PYR]D:401 |
x,y,z |
1_555 |
4 |
1 |
206 |
15.2 |
0.5 |
0.577 |
0 |
0 |
0 |
0.000 |
43 |
49 |
|
[FMT]A:406 |
1 |
1 |
149 |
◊ |
[PYR]A:401 |
x,y,z |
1_555 |
3 |
1 |
205 |
14.7 |
0.5 |
0.577 |
0 |
0 |
0 |
0.000 |
44 |
50 |
|
[FMT]C:403 |
1 |
1 |
149 |
◊ |
[PYR]C:401 |
x,y,z |
1_555 |
3 |
1 |
205 |
13.9 |
0.5 |
0.577 |
0 |
0 |
0 |
0.000 |
|