| ## |
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 |
190 |
45 |
14233 |
◊ |
B |
-x+1,y,-z |
2_655 |
188 |
45 |
14233 |
1809.4 |
-10.7 |
0.339 |
38 |
12 |
0 |
0.505 |
2 |
|
D |
188 |
44 |
14188 |
◊ |
D |
-x+1,y,-z+1 |
2_656 |
188 |
44 |
14188 |
1797.1 |
-11.6 |
0.302 |
40 |
12 |
0 |
0.505 |
3 |
|
C |
189 |
46 |
15011 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
186 |
46 |
15011 |
1785.2 |
-8.6 |
0.506 |
40 |
10 |
0 |
0.505 |
4 |
|
A |
191 |
46 |
15045 |
◊ |
A |
-x+1,y,-z |
2_655 |
191 |
46 |
15045 |
1774.1 |
-9.5 |
0.416 |
38 |
12 |
0 |
0.505 |
| Average: |
1791.5 |
-10.1 |
0.391 |
39 |
12 |
0 |
0.505 |
| 2 |
5 |
|
B |
140 |
34 |
14233 |
◊ |
A |
x,y,z |
1_555 |
137 |
33 |
15045 |
1369.2 |
-13.9 |
0.122 |
22 |
4 |
0 |
0.482 |
| 3 |
6 |
|
D |
129 |
34 |
14188 |
◊ |
C |
x,y,z |
1_555 |
131 |
32 |
15011 |
1308.1 |
-18.8 |
0.023 |
8 |
0 |
0 |
0.419 |
| 4 |
7 |
|
A |
47 |
11 |
15045 |
◊ |
B |
x-1/2,y+1/2,z |
3_455 |
50 |
15 |
14233 |
457.0 |
-0.1 |
0.425 |
4 |
3 |
0 |
0.000 |
| 5 |
8 |
|
D |
48 |
13 |
14188 |
◊ |
A |
x,y,z |
1_555 |
59 |
16 |
15045 |
449.1 |
1.7 |
0.802 |
3 |
4 |
0 |
0.000 |
| 6 |
9 |
|
C |
45 |
13 |
15011 |
◊ |
D |
x-1/2,y-1/2,z |
3_445 |
49 |
12 |
14188 |
396.9 |
0.1 |
0.678 |
2 |
2 |
0 |
0.000 |
| 7 |
10 |
|
[HKX]D:400 |
26 |
1 |
587 |
f |
D |
x,y,z |
1_555 |
57 |
18 |
14188 |
371.9 |
-5.1 |
0.482 |
2 |
0 |
0 |
0.236 |
11 |
|
[HKX]C:400 |
26 |
1 |
592 |
f |
C |
x,y,z |
1_555 |
59 |
18 |
15011 |
370.7 |
-5.1 |
0.517 |
2 |
0 |
0 |
0.236 |
12 |
|
[HKX]A:400 |
26 |
1 |
588 |
f |
A |
x,y,z |
1_555 |
58 |
19 |
15045 |
368.9 |
-5.1 |
0.486 |
2 |
0 |
0 |
0.236 |
13 |
|
[HKX]B:400 |
26 |
1 |
582 |
f |
B |
x,y,z |
1_555 |
56 |
18 |
14233 |
362.6 |
-5.0 |
0.479 |
2 |
0 |
0 |
0.236 |
| Average: |
368.5 |
-5.1 |
0.491 |
2 |
0 |
0 |
0.236 |
| 8 |
14 |
|
C |
48 |
13 |
15011 |
◊ |
A |
x,y,z |
1_555 |
38 |
12 |
15045 |
369.2 |
-3.9 |
0.309 |
3 |
0 |
0 |
0.000 |
| 9 |
15 |
|
C |
34 |
11 |
15011 |
◊ |
B |
x,y,z |
1_555 |
30 |
11 |
14233 |
277.7 |
-0.3 |
0.638 |
1 |
2 |
0 |
0.000 |
| 10 |
16 |
|
C |
18 |
7 |
15011 |
◊ |
C |
-x,y,-z+1 |
2_556 |
18 |
7 |
15011 |
190.3 |
0.2 |
0.683 |
4 |
2 |
0 |
0.000 |
17 |
|
A |
18 |
6 |
15045 |
◊ |
A |
-x,y,-z |
2_555 |
17 |
6 |
15045 |
185.2 |
-0.3 |
0.595 |
4 |
2 |
0 |
0.000 |
| Average: |
187.7 |
-0.0 |
0.639 |
4 |
2 |
0 |
0.000 |
| 11 |
18 |
|
[MES]B:1294 |
12 |
1 |
338 |
◊ |
B |
x,y,z |
1_555 |
25 |
9 |
14233 |
174.0 |
4.1 |
0.118 |
0 |
0 |
0 |
0.000 |
| 12 |
19 |
|
[MES]C:1294 |
12 |
1 |
338 |
◊ |
C |
x,y,z |
1_555 |
27 |
9 |
15011 |
170.7 |
3.7 |
0.104 |
0 |
0 |
0 |
0.000 |
| 13 |
20 |
|
[MES]A:1294 |
12 |
1 |
339 |
◊ |
A |
x,y,z |
1_555 |
27 |
9 |
15045 |
169.9 |
3.6 |
0.103 |
0 |
0 |
0 |
0.000 |
| 14 |
21 |
|
[MES]D:1294 |
12 |
1 |
339 |
◊ |
D |
x,y,z |
1_555 |
25 |
9 |
14188 |
159.2 |
3.3 |
0.082 |
0 |
0 |
0 |
0.000 |
| 15 |
22 |
|
[GOL]D:1296 |
6 |
1 |
222 |
f |
D |
x,y,z |
1_555 |
22 |
8 |
14188 |
134.9 |
-0.5 |
0.493 |
3 |
0 |
0 |
0.052 |
| 16 |
23 |
|
[GOL]D:1297 |
6 |
1 |
219 |
f |
D |
x,y,z |
1_555 |
24 |
10 |
14188 |
120.5 |
-1.1 |
0.461 |
3 |
0 |
0 |
0.069 |
| 17 |
24 |
|
[GOL]A:1296 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
23 |
10 |
15045 |
118.2 |
-0.0 |
0.548 |
3 |
0 |
0 |
0.045 |
| 18 |
25 |
|
[GOL]C:1296 |
6 |
1 |
219 |
f |
C |
x,y,z |
1_555 |
23 |
10 |
15011 |
115.7 |
-1.1 |
0.486 |
2 |
0 |
0 |
0.063 |
| 19 |
26 |
|
[HKX]D:400 |
12 |
1 |
587 |
◊ |
D |
-x+1,y,-z+1 |
2_656 |
11 |
2 |
14188 |
86.1 |
-0.5 |
0.759 |
0 |
0 |
0 |
0.021 |
27 |
|
[HKX]A:400 |
13 |
1 |
588 |
◊ |
A |
-x+1,y,-z |
2_655 |
11 |
2 |
15045 |
85.1 |
-0.5 |
0.755 |
0 |
0 |
0 |
0.021 |
28 |
|
[HKX]C:400 |
12 |
1 |
592 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
10 |
2 |
15011 |
84.6 |
-0.5 |
0.753 |
0 |
0 |
0 |
0.021 |
29 |
|
[HKX]B:400 |
11 |
1 |
582 |
◊ |
B |
-x+1,y,-z |
2_655 |
11 |
2 |
14233 |
84.6 |
-0.6 |
0.711 |
0 |
0 |
0 |
0.021 |
| Average: |
85.1 |
-0.5 |
0.745 |
0 |
0 |
0 |
0.021 |
| 20 |
30 |
|
[CL]A:1295 |
1 |
1 |
125 |
f |
A |
-x+1,y,-z |
2_655 |
7 |
4 |
15045 |
51.1 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.286 |
31 |
|
[CL]D:1295 |
1 |
1 |
125 |
f |
D |
-x+1,y,-z+1 |
2_656 |
7 |
4 |
14188 |
50.5 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.286 |
32 |
|
[CL]B:1295 |
1 |
1 |
125 |
f |
B |
-x+1,y,-z |
2_655 |
7 |
4 |
14233 |
50.3 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.286 |
33 |
|
[CL]C:1295 |
1 |
1 |
125 |
f |
C |
-x+1,y,-z+1 |
2_656 |
7 |
4 |
15011 |
50.3 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.286 |
| Average: |
50.5 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.286 |
| 21 |
34 |
|
[CL]B:1295 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
14233 |
40.8 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.164 |
35 |
|
[CL]C:1295 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
8 |
3 |
15011 |
40.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.164 |
36 |
|
[CL]A:1295 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
15045 |
40.2 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.164 |
37 |
|
[CL]D:1295 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
7 |
3 |
14188 |
40.0 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.164 |
| Average: |
40.4 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.164 |
| 22 |
38 |
|
[MES]C:1294 |
3 |
1 |
338 |
f |
C |
-x+1,y,-z+1 |
2_656 |
8 |
1 |
15011 |
40.0 |
0.8 |
0.314 |
0 |
0 |
0 |
0.000 |
| 23 |
39 |
|
[MES]B:1294 |
3 |
1 |
338 |
f |
B |
-x+1,y,-z |
2_655 |
8 |
1 |
14233 |
39.1 |
0.8 |
0.300 |
0 |
0 |
0 |
0.000 |
| 24 |
40 |
|
[MES]A:1294 |
3 |
1 |
339 |
f |
A |
-x+1,y,-z |
2_655 |
8 |
1 |
15045 |
38.7 |
0.8 |
0.298 |
0 |
0 |
0 |
0.000 |
| 25 |
41 |
|
[MES]D:1294 |
3 |
1 |
339 |
f |
D |
-x+1,y,-z+1 |
2_656 |
8 |
1 |
14188 |
38.4 |
0.9 |
0.333 |
0 |
0 |
0 |
0.000 |
| 26 |
42 |
|
B |
2 |
1 |
14233 |
x |
B |
x-1,y,z |
1_455 |
3 |
1 |
14233 |
31.9 |
0.9 |
0.892 |
1 |
2 |
0 |
0.000 |
| 27 |
43 |
|
[GOL]D:1297 |
3 |
1 |
219 |
◊ |
D |
-x+1,y,-z+1 |
2_656 |
2 |
1 |
14188 |
29.7 |
-0.9 |
0.232 |
0 |
0 |
0 |
0.025 |
| 28 |
44 |
|
[GOL]C:1296 |
2 |
1 |
219 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
2 |
1 |
15011 |
28.7 |
-0.7 |
0.277 |
0 |
0 |
0 |
0.021 |
| 29 |
45 |
|
[GOL]A:1296 |
2 |
1 |
219 |
◊ |
A |
-x+1,y,-z |
2_655 |
2 |
1 |
15045 |
27.7 |
-0.1 |
0.340 |
0 |
0 |
0 |
0.004 |
| 30 |
46 |
|
D |
1 |
1 |
14188 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
1 |
1 |
15011 |
23.4 |
0.5 |
0.907 |
0 |
0 |
0 |
0.000 |
47 |
|
B |
3 |
1 |
14233 |
◊ |
A |
-x+1,y,-z |
2_655 |
3 |
1 |
15045 |
19.2 |
0.4 |
0.760 |
0 |
0 |
0 |
0.000 |
| Average: |
21.3 |
0.5 |
0.834 |
0 |
0 |
0 |
0.000 |
| 31 |
48 |
|
D |
2 |
1 |
14188 |
◊ |
B |
x-1/2,y+1/2,z |
3_455 |
2 |
1 |
14233 |
17.4 |
0.2 |
0.583 |
0 |
0 |
0 |
0.000 |
| 32 |
49 |
|
[CL]B:1295 |
1 |
1 |
125 |
◊ |
[HKX]B:400 |
x,y,z |
1_555 |
1 |
1 |
582 |
10.9 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.030 |
50 |
|
[CL]D:1295 |
1 |
1 |
125 |
◊ |
[HKX]D:400 |
x,y,z |
1_555 |
1 |
1 |
587 |
10.5 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.030 |
51 |
|
[CL]C:1295 |
1 |
1 |
125 |
◊ |
[HKX]C:400 |
x,y,z |
1_555 |
1 |
1 |
592 |
10.0 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.030 |
52 |
|
[CL]A:1295 |
1 |
1 |
125 |
◊ |
[HKX]A:400 |
x,y,z |
1_555 |
1 |
1 |
588 |
9.9 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.030 |
| Average: |
10.3 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.030 |
| 33 |
53 |
|
C |
2 |
1 |
15011 |
x |
C |
x-1,y,z |
1_455 |
1 |
1 |
15011 |
5.5 |
-0.2 |
0.362 |
0 |
0 |
0 |
0.000 |
| 34 |
54 |
|
[GOL]D:1296 |
1 |
1 |
222 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
15011 |
4.0 |
-0.0 |
0.420 |
0 |
0 |
0 |
0.000 |
|