| ## |
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 |
141 |
40 |
14910 |
◊ |
A |
x,y,z |
1_555 |
130 |
35 |
14800 |
1292.7 |
-15.7 |
0.065 |
13 |
13 |
0 |
1.000 |
2 |
|
D |
140 |
36 |
14806 |
◊ |
C |
x,y,z |
1_555 |
131 |
34 |
15037 |
1285.0 |
-16.4 |
0.053 |
13 |
14 |
0 |
1.000 |
3 |
|
F |
136 |
34 |
14575 |
◊ |
E |
x,y,z |
1_555 |
117 |
31 |
15107 |
1204.5 |
-17.4 |
0.032 |
14 |
14 |
0 |
1.000 |
4 |
|
H |
124 |
33 |
14806 |
◊ |
G |
x,y,z |
1_555 |
128 |
31 |
14634 |
1199.3 |
-16.4 |
0.035 |
16 |
14 |
0 |
1.000 |
5 |
|
J |
121 |
31 |
14282 |
◊ |
I |
x,y,z |
1_555 |
122 |
30 |
14911 |
1141.6 |
-15.9 |
0.055 |
16 |
14 |
0 |
1.000 |
6 |
|
L |
122 |
32 |
14945 |
◊ |
K |
x,y,z |
1_555 |
103 |
26 |
13904 |
1073.8 |
-15.8 |
0.041 |
14 |
14 |
0 |
1.000 |
| Average: |
1199.5 |
-16.3 |
0.047 |
14 |
14 |
0 |
1.000 |
| 2 |
7 |
|
L |
69 |
26 |
14945 |
◊ |
A |
x,y,z |
1_555 |
69 |
26 |
14800 |
647.2 |
-0.1 |
0.668 |
8 |
4 |
0 |
0.000 |
8 |
|
E |
65 |
25 |
15107 |
◊ |
D |
x,y,z |
1_555 |
66 |
23 |
14806 |
618.0 |
-1.0 |
0.615 |
8 |
4 |
0 |
0.000 |
9 |
|
J |
65 |
24 |
14282 |
◊ |
G |
x,y,z |
1_555 |
64 |
23 |
14634 |
613.9 |
-1.3 |
0.616 |
7 |
4 |
0 |
0.000 |
| Average: |
626.4 |
-0.8 |
0.633 |
8 |
4 |
0 |
0.000 |
| 3 |
10 |
|
A |
69 |
23 |
14800 |
◊ |
K |
-x+1/2,-y,z-1/2 |
2_554 |
68 |
23 |
13904 |
639.1 |
-4.4 |
0.319 |
6 |
4 |
0 |
0.000 |
11 |
|
E |
69 |
20 |
15107 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
58 |
21 |
15037 |
546.2 |
-1.8 |
0.564 |
4 |
3 |
0 |
0.000 |
| Average: |
592.6 |
-3.1 |
0.441 |
5 |
4 |
0 |
0.000 |
| 4 |
12 |
|
G |
65 |
21 |
14634 |
◊ |
D |
x,y,z |
1_555 |
63 |
22 |
14806 |
559.7 |
2.7 |
0.832 |
12 |
2 |
0 |
0.006 |
13 |
|
E |
58 |
20 |
15107 |
◊ |
A |
x,y,z |
1_555 |
61 |
22 |
14800 |
552.8 |
4.7 |
0.909 |
12 |
4 |
0 |
0.006 |
14 |
|
L |
59 |
23 |
14945 |
◊ |
J |
x,y,z |
1_555 |
61 |
22 |
14282 |
549.7 |
3.2 |
0.855 |
12 |
2 |
0 |
0.006 |
| Average: |
554.1 |
3.5 |
0.865 |
12 |
3 |
0 |
0.006 |
| 5 |
15 |
|
A |
58 |
22 |
14800 |
◊ |
E |
x-1/2,-y-1/2,-z |
4_445 |
59 |
22 |
15107 |
550.1 |
-3.0 |
0.453 |
5 |
1 |
0 |
0.000 |
| 6 |
16 |
|
G |
51 |
18 |
14634 |
◊ |
C |
x,y,z |
1_555 |
55 |
17 |
15037 |
470.1 |
-4.4 |
0.303 |
1 |
1 |
0 |
0.010 |
| 7 |
17 |
|
H |
56 |
18 |
14806 |
◊ |
D |
x,y,z |
1_555 |
52 |
19 |
14806 |
466.2 |
-4.0 |
0.319 |
3 |
1 |
0 |
0.011 |
18 |
|
L |
48 |
18 |
14945 |
◊ |
I |
x,y,z |
1_555 |
53 |
18 |
14911 |
441.9 |
-3.4 |
0.357 |
3 |
0 |
0 |
0.011 |
19 |
|
E |
46 |
19 |
15107 |
◊ |
B |
x,y,z |
1_555 |
55 |
19 |
14910 |
434.3 |
-2.9 |
0.428 |
3 |
2 |
0 |
0.011 |
| Average: |
447.5 |
-3.5 |
0.368 |
3 |
1 |
0 |
0.011 |
| 8 |
20 |
|
B |
31 |
10 |
14910 |
◊ |
I |
-x+1/2,-y,z-1/2 |
2_554 |
34 |
8 |
14911 |
322.2 |
-0.5 |
0.587 |
3 |
3 |
0 |
0.000 |
| 9 |
21 |
|
B |
28 |
7 |
14910 |
◊ |
H |
x-1/2,-y-1/2,-z |
4_445 |
33 |
10 |
14806 |
263.6 |
-2.6 |
0.286 |
2 |
5 |
0 |
0.000 |
| 10 |
22 |
|
K |
33 |
11 |
13904 |
◊ |
J |
x,y,z |
1_555 |
32 |
12 |
14282 |
254.6 |
-2.3 |
0.418 |
1 |
0 |
0 |
0.000 |
23 |
|
F |
21 |
8 |
14575 |
◊ |
A |
x,y,z |
1_555 |
20 |
8 |
14800 |
158.4 |
-0.7 |
0.541 |
1 |
0 |
0 |
0.000 |
| Average: |
206.5 |
-1.5 |
0.479 |
1 |
0 |
0 |
0.000 |
| 11 |
24 |
|
[MES]D:1335 |
12 |
1 |
338 |
f |
D |
x,y,z |
1_555 |
33 |
15 |
14806 |
239.8 |
4.9 |
0.276 |
0 |
0 |
0 |
0.000 |
| 12 |
25 |
|
[MES]G:1335 |
12 |
1 |
337 |
f |
G |
x,y,z |
1_555 |
32 |
15 |
14634 |
239.1 |
4.9 |
0.282 |
0 |
0 |
0 |
0.000 |
| 13 |
26 |
|
[MES]F:1335 |
12 |
1 |
337 |
f |
F |
x,y,z |
1_555 |
35 |
16 |
14575 |
238.6 |
4.6 |
0.275 |
0 |
0 |
0 |
0.000 |
| 14 |
27 |
|
[MES]I:1335 |
12 |
1 |
337 |
f |
I |
x,y,z |
1_555 |
36 |
17 |
14911 |
237.3 |
5.0 |
0.347 |
0 |
0 |
0 |
0.000 |
| 15 |
28 |
|
[MES]H:1335 |
12 |
1 |
336 |
f |
H |
x,y,z |
1_555 |
35 |
17 |
14806 |
236.5 |
4.8 |
0.320 |
0 |
0 |
0 |
0.000 |
| 16 |
29 |
|
H |
28 |
8 |
14806 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
26 |
8 |
15037 |
230.9 |
-2.4 |
0.240 |
0 |
0 |
0 |
0.000 |
30 |
|
I |
25 |
8 |
14911 |
◊ |
K |
-x+1/2,-y,z-1/2 |
2_554 |
24 |
7 |
13904 |
221.7 |
-2.0 |
0.337 |
2 |
2 |
0 |
0.000 |
| Average: |
226.3 |
-2.2 |
0.288 |
1 |
1 |
0 |
0.000 |
| 17 |
31 |
|
F |
26 |
10 |
14575 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
21 |
10 |
14910 |
223.9 |
-0.8 |
0.527 |
2 |
1 |
0 |
0.000 |
| 18 |
32 |
|
L |
18 |
7 |
14945 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
24 |
7 |
14910 |
202.8 |
-1.3 |
0.429 |
2 |
2 |
0 |
0.000 |
| 19 |
33 |
|
D |
22 |
7 |
14806 |
◊ |
B |
x,y,z |
1_555 |
20 |
6 |
14910 |
181.9 |
-0.7 |
0.524 |
1 |
0 |
0 |
0.000 |
34 |
|
H |
19 |
6 |
14806 |
◊ |
E |
x,y,z |
1_555 |
21 |
6 |
15107 |
169.0 |
-0.2 |
0.581 |
1 |
0 |
0 |
0.000 |
35 |
|
I |
17 |
5 |
14911 |
◊ |
A |
x,y,z |
1_555 |
19 |
6 |
14800 |
148.5 |
-0.4 |
0.559 |
1 |
0 |
0 |
0.000 |
36 |
|
J |
15 |
5 |
14282 |
◊ |
C |
x,y,z |
1_555 |
12 |
3 |
15037 |
111.9 |
-1.2 |
0.390 |
1 |
0 |
0 |
0.000 |
37 |
|
L |
12 |
5 |
14945 |
◊ |
F |
x,y,z |
1_555 |
11 |
4 |
14575 |
108.9 |
-1.1 |
0.394 |
1 |
1 |
0 |
0.000 |
38 |
|
K |
5 |
2 |
13904 |
◊ |
G |
x,y,z |
1_555 |
4 |
2 |
14634 |
27.2 |
-0.1 |
0.527 |
0 |
0 |
0 |
0.000 |
| Average: |
124.6 |
-0.6 |
0.496 |
1 |
0 |
0 |
0.000 |
| 20 |
39 |
|
L |
13 |
4 |
14945 |
◊ |
E |
x,y,z |
1_555 |
22 |
7 |
15107 |
154.4 |
1.3 |
0.776 |
1 |
1 |
0 |
0.000 |
40 |
|
J |
18 |
6 |
14282 |
◊ |
D |
x,y,z |
1_555 |
17 |
6 |
14806 |
130.5 |
0.7 |
0.715 |
1 |
2 |
0 |
0.000 |
41 |
|
D |
14 |
4 |
14806 |
◊ |
A |
x,y,z |
1_555 |
17 |
4 |
14800 |
130.1 |
1.6 |
0.798 |
2 |
2 |
0 |
0.000 |
42 |
|
G |
14 |
5 |
14634 |
◊ |
E |
x,y,z |
1_555 |
17 |
5 |
15107 |
128.3 |
0.3 |
0.677 |
1 |
2 |
0 |
0.000 |
43 |
|
J |
17 |
7 |
14282 |
◊ |
A |
x,y,z |
1_555 |
19 |
6 |
14800 |
123.4 |
0.5 |
0.696 |
1 |
1 |
0 |
0.000 |
44 |
|
L |
15 |
4 |
14945 |
◊ |
G |
x,y,z |
1_555 |
10 |
4 |
14634 |
110.5 |
1.9 |
0.794 |
0 |
0 |
0 |
0.000 |
| Average: |
129.5 |
1.0 |
0.743 |
1 |
1 |
0 |
0.000 |
| 21 |
45 |
|
G |
17 |
7 |
14634 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
16 |
8 |
15037 |
154.3 |
0.4 |
0.678 |
1 |
0 |
0 |
0.000 |
| 22 |
46 |
|
J |
10 |
5 |
14282 |
◊ |
K |
-x+1/2,-y,z-1/2 |
2_554 |
18 |
7 |
13904 |
128.0 |
0.6 |
0.725 |
1 |
0 |
0 |
0.000 |
| 23 |
47 |
|
F |
16 |
7 |
14575 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
11 |
7 |
14806 |
126.5 |
-1.2 |
0.351 |
0 |
0 |
0 |
0.000 |
| 24 |
48 |
|
F |
15 |
5 |
14575 |
◊ |
H |
-x+1,y-1/2,-z+1/2 |
3_645 |
15 |
5 |
14806 |
111.3 |
0.6 |
0.675 |
1 |
1 |
0 |
0.000 |
| 25 |
49 |
|
A |
7 |
2 |
14800 |
◊ |
H |
x-1/2,-y-1/2,-z |
4_445 |
8 |
3 |
14806 |
66.0 |
-0.3 |
0.454 |
0 |
0 |
0 |
0.000 |
| 26 |
50 |
|
I |
4 |
2 |
14911 |
◊ |
F |
x-1/2,-y-1/2,-z |
4_445 |
2 |
1 |
14575 |
39.4 |
-0.2 |
0.490 |
0 |
0 |
0 |
0.000 |
| 27 |
51 |
|
E |
4 |
2 |
15107 |
◊ |
G |
-x+1,y-1/2,-z+1/2 |
3_645 |
3 |
1 |
14634 |
30.9 |
0.5 |
0.798 |
1 |
0 |
0 |
0.000 |
52 |
|
A |
1 |
1 |
14800 |
◊ |
J |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
14282 |
7.5 |
0.0 |
0.474 |
0 |
0 |
0 |
0.000 |
| Average: |
19.2 |
0.3 |
0.636 |
1 |
0 |
0 |
0.000 |
| 28 |
53 |
|
F |
3 |
2 |
14575 |
◊ |
H |
x-1/2,-y-1/2,-z |
4_445 |
2 |
1 |
14806 |
17.9 |
0.2 |
0.661 |
0 |
0 |
0 |
0.000 |
| 29 |
54 |
|
B |
3 |
2 |
14910 |
◊ |
J |
-x+1/2,-y,z-1/2 |
2_554 |
2 |
1 |
14282 |
10.9 |
-0.1 |
0.530 |
0 |
0 |
0 |
0.000 |
| 30 |
55 |
|
D |
1 |
1 |
14806 |
◊ |
K |
-x+1/2,-y,z-1/2 |
2_554 |
3 |
1 |
13904 |
8.4 |
0.2 |
0.772 |
0 |
0 |
0 |
0.000 |
| 31 |
56 |
|
I |
1 |
1 |
14911 |
◊ |
E |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
15107 |
5.9 |
0.0 |
0.508 |
0 |
0 |
0 |
0.000 |
| 32 |
57 |
|
B |
1 |
1 |
14910 |
◊ |
K |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
13904 |
0.2 |
-0.0 |
0.626 |
0 |
0 |
0 |
0.000 |
|