## |
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 |
332 |
84 |
10598 |
◊ |
C |
x,y,z |
1_555 |
338 |
83 |
10622 |
3151.9 |
-30.9 |
0.089 |
47 |
10 |
0 |
0.569 |
2 |
|
B |
333 |
82 |
10617 |
◊ |
A |
x,y,z |
1_555 |
335 |
82 |
10666 |
3148.8 |
-28.7 |
0.110 |
48 |
11 |
0 |
0.569 |
Average: |
3150.4 |
-29.8 |
0.100 |
48 |
11 |
0 |
0.569 |
2 |
3 |
|
A |
37 |
9 |
10666 |
◊ |
C |
x,y,z-1 |
1_554 |
35 |
10 |
10622 |
293.6 |
-1.1 |
0.545 |
5 |
0 |
0 |
0.000 |
4 |
|
D |
33 |
7 |
10598 |
◊ |
B |
x,y,z |
1_555 |
34 |
9 |
10617 |
284.6 |
-1.3 |
0.521 |
5 |
0 |
0 |
0.000 |
Average: |
289.1 |
-1.2 |
0.533 |
5 |
0 |
0 |
0.000 |
3 |
5 |
|
[FMN]C:300 |
29 |
1 |
615 |
f |
C |
x,y,z |
1_555 |
44 |
15 |
10622 |
286.9 |
-3.8 |
0.558 |
14 |
0 |
0 |
0.215 |
6 |
|
[FMN]B:300 |
29 |
1 |
619 |
f |
B |
x,y,z |
1_555 |
44 |
16 |
10617 |
281.2 |
-3.6 |
0.556 |
14 |
0 |
0 |
0.215 |
7 |
|
[FMN]D:300 |
29 |
1 |
615 |
f |
D |
x,y,z |
1_555 |
41 |
15 |
10598 |
274.4 |
-3.7 |
0.540 |
14 |
0 |
0 |
0.215 |
8 |
|
[FMN]A:300 |
28 |
1 |
614 |
f |
A |
x,y,z |
1_555 |
42 |
16 |
10666 |
273.2 |
-3.8 |
0.530 |
14 |
0 |
0 |
0.215 |
Average: |
278.9 |
-3.7 |
0.546 |
14 |
0 |
0 |
0.215 |
4 |
9 |
|
D |
22 |
8 |
10598 |
x |
D |
-x,y-1/2,-z+1 |
2_546 |
22 |
7 |
10598 |
226.4 |
-3.3 |
0.237 |
1 |
0 |
0 |
0.000 |
10 |
|
A |
22 |
7 |
10666 |
x |
A |
-x,y-1/2,-z |
2_545 |
22 |
8 |
10666 |
219.0 |
-3.2 |
0.219 |
1 |
0 |
0 |
0.000 |
Average: |
222.7 |
-3.2 |
0.228 |
1 |
0 |
0 |
0.000 |
5 |
11 |
|
C |
25 |
8 |
10622 |
◊ |
B |
x,y,z |
1_555 |
22 |
7 |
10617 |
177.2 |
-1.8 |
0.210 |
1 |
0 |
0 |
0.000 |
12 |
|
B |
23 |
7 |
10617 |
◊ |
C |
x,y,z-1 |
1_554 |
22 |
7 |
10622 |
171.7 |
-1.8 |
0.215 |
1 |
0 |
0 |
0.000 |
Average: |
174.5 |
-1.8 |
0.213 |
1 |
0 |
0 |
0.000 |
6 |
13 |
|
[FMN]C:300 |
19 |
1 |
615 |
◊ |
D |
x,y,z |
1_555 |
27 |
11 |
10598 |
176.9 |
-2.6 |
0.419 |
1 |
0 |
0 |
0.059 |
14 |
|
[FMN]B:300 |
21 |
1 |
619 |
◊ |
A |
x,y,z |
1_555 |
27 |
11 |
10666 |
174.2 |
-2.6 |
0.415 |
0 |
0 |
0 |
0.059 |
15 |
|
[FMN]A:300 |
19 |
1 |
614 |
◊ |
B |
x,y,z |
1_555 |
25 |
10 |
10617 |
164.3 |
-2.6 |
0.407 |
0 |
0 |
0 |
0.059 |
16 |
|
[FMN]D:300 |
18 |
1 |
615 |
◊ |
C |
x,y,z |
1_555 |
25 |
10 |
10622 |
162.5 |
-2.5 |
0.399 |
0 |
0 |
0 |
0.059 |
Average: |
169.5 |
-2.6 |
0.410 |
0 |
0 |
0 |
0.059 |
7 |
17 |
|
B |
20 |
7 |
10617 |
◊ |
A |
x-1,y,z |
1_455 |
18 |
5 |
10666 |
172.3 |
1.0 |
0.756 |
4 |
2 |
0 |
0.000 |
8 |
18 |
|
[GOL]C:174 |
6 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
22 |
9 |
10622 |
146.8 |
-1.1 |
0.499 |
3 |
0 |
0 |
0.026 |
9 |
19 |
|
B |
13 |
3 |
10617 |
x |
B |
x-1,y,z |
1_455 |
10 |
5 |
10617 |
113.8 |
-0.5 |
0.456 |
1 |
0 |
0 |
0.000 |
20 |
|
A |
12 |
5 |
10666 |
x |
A |
x-1,y,z |
1_455 |
13 |
3 |
10666 |
113.6 |
-0.5 |
0.481 |
1 |
0 |
0 |
0.000 |
Average: |
113.7 |
-0.5 |
0.469 |
1 |
0 |
0 |
0.000 |
10 |
21 |
|
[GOL]B:175 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
21 |
7 |
10617 |
101.8 |
-1.0 |
0.464 |
2 |
0 |
0 |
0.020 |
11 |
22 |
|
[GOL]A:173 |
5 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
10666 |
99.5 |
0.2 |
0.612 |
2 |
0 |
0 |
0.008 |
12 |
23 |
|
[GOL]D:173 |
5 |
1 |
218 |
f |
D |
x,y,z |
1_555 |
12 |
7 |
10598 |
99.5 |
0.0 |
0.571 |
1 |
0 |
0 |
0.004 |
13 |
24 |
|
[GOL]C:173 |
6 |
1 |
220 |
f |
C |
x,y,z |
1_555 |
20 |
6 |
10622 |
98.9 |
-0.7 |
0.528 |
2 |
0 |
0 |
0.017 |
14 |
25 |
|
[GOL]D:174 |
6 |
1 |
220 |
f |
D |
x,y,z |
1_555 |
15 |
5 |
10598 |
96.9 |
-0.3 |
0.516 |
1 |
0 |
0 |
0.008 |
15 |
26 |
|
[GOL]A:176 |
6 |
1 |
215 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
10666 |
96.8 |
0.1 |
0.634 |
1 |
0 |
0 |
0.003 |
16 |
27 |
|
[GOL]A:175 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
10666 |
91.3 |
0.1 |
0.595 |
5 |
0 |
0 |
0.023 |
17 |
28 |
|
[GOL]D:174 |
6 |
1 |
220 |
◊ |
C |
x,y,z |
1_555 |
15 |
5 |
10622 |
91.1 |
0.0 |
0.591 |
1 |
0 |
0 |
0.004 |
18 |
29 |
|
[GOL]C:175 |
6 |
1 |
222 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
10622 |
88.2 |
-0.5 |
0.498 |
1 |
0 |
0 |
0.010 |
19 |
30 |
|
[GOL]B:177 |
6 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
21 |
5 |
10666 |
85.7 |
-0.8 |
0.486 |
0 |
0 |
0 |
0.008 |
20 |
31 |
|
[GOL]A:176 |
5 |
1 |
215 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
10617 |
85.2 |
-0.3 |
0.541 |
1 |
0 |
0 |
0.008 |
21 |
32 |
|
[GOL]B:177 |
5 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
10617 |
82.2 |
-1.0 |
0.394 |
1 |
0 |
0 |
0.015 |
22 |
33 |
|
[FMN]D:300 |
14 |
1 |
615 |
◊ |
B |
x,y,z |
1_555 |
9 |
3 |
10617 |
79.9 |
-0.5 |
0.333 |
0 |
0 |
0 |
0.000 |
34 |
|
[FMN]A:300 |
15 |
1 |
614 |
◊ |
C |
x,y,z-1 |
1_554 |
10 |
3 |
10622 |
79.1 |
-0.5 |
0.372 |
0 |
0 |
0 |
0.000 |
Average: |
79.5 |
-0.5 |
0.352 |
0 |
0 |
0 |
0.000 |
23 |
35 |
|
[GOL]D:175 |
6 |
1 |
218 |
◊ |
D |
x,y,z |
1_555 |
14 |
5 |
10598 |
79.6 |
-0.8 |
0.490 |
1 |
0 |
0 |
0.013 |
24 |
36 |
|
[GOL]A:174 |
6 |
1 |
217 |
◊ |
A |
x,y,z |
1_555 |
13 |
4 |
10666 |
77.5 |
-0.4 |
0.529 |
0 |
0 |
0 |
0.005 |
25 |
37 |
|
[GOL]D:175 |
5 |
1 |
218 |
f |
[FMN]C:300 |
x,y,z |
1_555 |
13 |
1 |
615 |
63.2 |
0.1 |
0.614 |
3 |
0 |
0 |
0.013 |
26 |
38 |
|
[GOL]B:176 |
5 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
10617 |
62.5 |
-0.1 |
0.554 |
0 |
0 |
0 |
0.001 |
27 |
39 |
|
[GOL]A:174 |
5 |
1 |
217 |
f |
[FMN]B:300 |
x,y,z |
1_555 |
15 |
1 |
619 |
55.8 |
-0.1 |
0.610 |
1 |
0 |
0 |
0.006 |
28 |
40 |
|
[GOL]D:175 |
5 |
1 |
218 |
f |
C |
x,y,z |
1_555 |
11 |
4 |
10622 |
54.4 |
0.1 |
0.620 |
1 |
0 |
0 |
0.003 |
29 |
41 |
|
[GOL]D:173 |
4 |
1 |
218 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
5 |
2 |
10598 |
50.0 |
0.5 |
0.637 |
1 |
0 |
0 |
0.000 |
30 |
42 |
|
A |
5 |
2 |
10666 |
◊ |
[GOL]A:173 |
-x,y-1/2,-z |
2_545 |
4 |
1 |
220 |
49.7 |
0.5 |
0.639 |
1 |
0 |
0 |
0.000 |
31 |
43 |
|
[GOL]A:174 |
5 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
10617 |
47.4 |
-0.6 |
0.488 |
0 |
0 |
0 |
0.007 |
32 |
44 |
|
[GOL]C:175 |
3 |
1 |
222 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
10598 |
44.7 |
0.9 |
0.811 |
2 |
0 |
0 |
0.000 |
33 |
45 |
|
[GOL]B:176 |
2 |
1 |
219 |
f |
[FMN]B:300 |
x,y,z |
1_555 |
7 |
1 |
619 |
40.7 |
-0.0 |
0.633 |
0 |
0 |
0 |
0.000 |
34 |
46 |
|
[CL]B:174 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
7 |
2 |
10617 |
39.6 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.056 |
47 |
|
[CL]B:173 |
1 |
1 |
125 |
f |
C |
x,y,z-1 |
1_554 |
7 |
2 |
10622 |
39.5 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.056 |
Average: |
39.6 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.056 |
35 |
48 |
|
D |
3 |
1 |
10598 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
4 |
1 |
10622 |
36.1 |
-0.4 |
0.352 |
0 |
0 |
0 |
0.000 |
49 |
|
B |
4 |
1 |
10617 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
3 |
1 |
10666 |
34.9 |
-0.4 |
0.352 |
0 |
0 |
0 |
0.000 |
Average: |
35.5 |
-0.4 |
0.352 |
0 |
0 |
0 |
0.000 |
36 |
50 |
|
D |
3 |
1 |
10598 |
◊ |
[GOL]C:173 |
-x,y-1/2,-z+1 |
2_546 |
3 |
1 |
220 |
35.9 |
-1.0 |
0.246 |
0 |
0 |
0 |
0.000 |
37 |
51 |
|
[CL]B:173 |
1 |
1 |
125 |
◊ |
[FMN]A:300 |
x,y,z |
1_555 |
12 |
1 |
614 |
35.6 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.000 |
52 |
|
[CL]B:174 |
1 |
1 |
125 |
◊ |
[FMN]D:300 |
x,y,z |
1_555 |
11 |
1 |
615 |
35.5 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
35.5 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.000 |
38 |
53 |
|
[GOL]B:175 |
5 |
1 |
220 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
3 |
1 |
10666 |
33.9 |
-0.9 |
0.263 |
0 |
0 |
0 |
0.000 |
39 |
54 |
|
B |
4 |
2 |
10617 |
◊ |
[GOL]A:173 |
-x,y-1/2,-z |
2_545 |
2 |
1 |
220 |
31.7 |
0.4 |
0.695 |
0 |
0 |
0 |
0.000 |
40 |
55 |
|
[GOL]D:173 |
2 |
1 |
218 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
4 |
2 |
10622 |
30.7 |
0.3 |
0.684 |
0 |
0 |
0 |
0.000 |
41 |
56 |
|
[GOL]B:175 |
3 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
10666 |
29.6 |
-0.6 |
0.233 |
0 |
0 |
0 |
0.006 |
42 |
57 |
|
[GOL]C:173 |
3 |
1 |
220 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
10598 |
27.7 |
-0.4 |
0.262 |
0 |
0 |
0 |
0.005 |
43 |
58 |
|
[CL]B:173 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
10617 |
26.0 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.000 |
59 |
|
[CL]B:174 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
10622 |
25.6 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
25.8 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.000 |
44 |
60 |
|
A |
2 |
1 |
10666 |
◊ |
[GOL]A:175 |
-x,y-1/2,-z |
2_545 |
3 |
1 |
219 |
24.6 |
-0.1 |
0.376 |
0 |
0 |
0 |
0.000 |
45 |
61 |
|
[GOL]B:176 |
3 |
1 |
219 |
f |
[GOL]A:174 |
x,y,z |
1_555 |
3 |
1 |
217 |
24.1 |
0.3 |
0.500 |
1 |
0 |
0 |
0.002 |
46 |
62 |
|
B |
1 |
1 |
10617 |
◊ |
[GOL]A:175 |
-x,y-1/2,-z |
2_545 |
4 |
1 |
219 |
16.4 |
0.1 |
0.648 |
0 |
0 |
0 |
0.000 |
47 |
63 |
|
[CL]B:174 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
2 |
2 |
10598 |
14.3 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
64 |
|
[CL]B:173 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
10666 |
13.6 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
13.9 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.000 |
48 |
65 |
|
A |
2 |
1 |
10666 |
◊ |
[GOL]C:174 |
x,y,z-1 |
1_554 |
1 |
1 |
216 |
8.2 |
0.2 |
0.601 |
0 |
0 |
0 |
0.000 |
49 |
66 |
|
[GOL]B:177 |
3 |
1 |
220 |
◊ |
C |
x,y,z-1 |
1_554 |
2 |
2 |
10622 |
7.7 |
0.2 |
0.609 |
0 |
0 |
0 |
0.000 |
50 |
67 |
|
B |
1 |
1 |
10617 |
◊ |
[GOL]C:174 |
x,y,z-1 |
1_554 |
1 |
1 |
216 |
3.3 |
-0.0 |
0.476 |
0 |
0 |
0 |
0.000 |
|