## |
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 |
160 |
43 |
17665 |
◊ |
C |
-x,y-1/2,-z-1 |
2_544 |
158 |
43 |
17637 |
1554.3 |
-10.6 |
0.185 |
23 |
8 |
0 |
0.522 |
2 |
|
D |
165 |
44 |
17589 |
◊ |
A |
-x-1,y-1/2,-z-1 |
2_444 |
153 |
44 |
17705 |
1534.1 |
-10.5 |
0.191 |
22 |
8 |
0 |
0.522 |
Average: |
1544.2 |
-10.6 |
0.188 |
23 |
8 |
0 |
0.522 |
2 |
3 |
|
[XYT]D:501 |
27 |
1 |
538 |
f |
D |
x,y,z |
1_555 |
46 |
19 |
17589 |
361.7 |
0.7 |
0.149 |
9 |
0 |
0 |
0.105 |
4 |
|
[XYT]C:501 |
26 |
1 |
540 |
f |
C |
x,y,z |
1_555 |
47 |
19 |
17637 |
359.1 |
0.4 |
0.141 |
8 |
0 |
0 |
0.105 |
Average: |
360.4 |
0.5 |
0.145 |
9 |
0 |
0 |
0.105 |
3 |
5 |
|
C |
47 |
18 |
17637 |
◊ |
A |
x,y,z-1 |
1_554 |
28 |
9 |
17705 |
316.7 |
-1.5 |
0.415 |
3 |
0 |
0 |
0.000 |
6 |
|
D |
35 |
11 |
17589 |
◊ |
B |
x,y,z |
1_555 |
27 |
7 |
17665 |
254.7 |
-1.4 |
0.307 |
1 |
0 |
0 |
0.000 |
Average: |
285.7 |
-1.5 |
0.361 |
2 |
0 |
0 |
0.000 |
4 |
7 |
|
C |
36 |
15 |
17637 |
◊ |
A |
x,y,z |
1_555 |
41 |
12 |
17705 |
292.9 |
1.2 |
0.751 |
4 |
1 |
0 |
0.000 |
8 |
|
D |
34 |
14 |
17589 |
◊ |
B |
x,y,z-1 |
1_554 |
39 |
13 |
17665 |
288.0 |
0.2 |
0.650 |
4 |
1 |
0 |
0.000 |
Average: |
290.5 |
0.7 |
0.700 |
4 |
1 |
0 |
0.000 |
5 |
9 |
|
D |
43 |
15 |
17589 |
◊ |
C |
x,y,z |
1_555 |
35 |
11 |
17637 |
288.1 |
0.3 |
0.659 |
4 |
2 |
0 |
0.000 |
10 |
|
D |
35 |
11 |
17589 |
◊ |
C |
x,y-1,z |
1_545 |
39 |
13 |
17637 |
277.7 |
0.6 |
0.687 |
3 |
2 |
0 |
0.000 |
Average: |
282.9 |
0.5 |
0.673 |
4 |
2 |
0 |
0.000 |
6 |
11 |
|
[BG6]A:501 |
16 |
1 |
384 |
f |
A |
x,y,z |
1_555 |
33 |
15 |
17705 |
258.7 |
-4.2 |
0.288 |
6 |
0 |
0 |
0.167 |
12 |
|
[BG6]B:501 |
16 |
1 |
384 |
f |
B |
x,y,z |
1_555 |
39 |
16 |
17665 |
257.6 |
-4.1 |
0.355 |
6 |
0 |
0 |
0.167 |
Average: |
258.2 |
-4.2 |
0.322 |
6 |
0 |
0 |
0.167 |
7 |
13 |
|
B |
30 |
7 |
17665 |
◊ |
A |
x,y,z |
1_555 |
28 |
8 |
17705 |
245.4 |
-2.2 |
0.260 |
3 |
0 |
0 |
0.000 |
14 |
|
B |
26 |
7 |
17665 |
◊ |
A |
x,y-1,z |
1_545 |
26 |
6 |
17705 |
229.7 |
-2.8 |
0.206 |
1 |
0 |
0 |
0.000 |
Average: |
237.6 |
-2.5 |
0.233 |
2 |
0 |
0 |
0.000 |
8 |
15 |
|
B |
24 |
9 |
17665 |
◊ |
C |
-x-1,y-1/2,-z-1 |
2_444 |
22 |
7 |
17637 |
148.8 |
1.5 |
0.776 |
0 |
0 |
0 |
0.000 |
9 |
16 |
|
[GOL]A:505 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
22 |
7 |
17705 |
137.2 |
-1.3 |
0.390 |
0 |
0 |
0 |
0.031 |
10 |
17 |
|
[GOL]B:502 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
21 |
7 |
17665 |
132.9 |
-1.2 |
0.353 |
0 |
0 |
0 |
0.027 |
11 |
18 |
|
[GOL]C:504 |
6 |
1 |
219 |
f |
C |
x,y,z |
1_555 |
21 |
5 |
17637 |
119.6 |
-0.5 |
0.588 |
4 |
0 |
0 |
0.049 |
12 |
19 |
|
[GOL]D:502 |
6 |
1 |
217 |
f |
D |
x,y,z |
1_555 |
21 |
5 |
17589 |
119.5 |
-0.7 |
0.513 |
3 |
0 |
0 |
0.098 |
20 |
|
[GOL]A:502 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
24 |
5 |
17705 |
117.9 |
-0.7 |
0.502 |
3 |
0 |
0 |
0.098 |
Average: |
118.7 |
-0.7 |
0.507 |
3 |
0 |
0 |
0.098 |
13 |
21 |
|
[GOL]B:503 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
21 |
5 |
17665 |
118.8 |
-0.5 |
0.529 |
3 |
0 |
0 |
0.041 |
14 |
22 |
|
[GOL]A:506 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
26 |
9 |
17705 |
112.3 |
-1.0 |
0.431 |
1 |
0 |
0 |
0.036 |
15 |
23 |
|
D |
17 |
5 |
17589 |
◊ |
A |
-x,y-1/2,-z-1 |
2_544 |
13 |
7 |
17705 |
111.0 |
1.1 |
0.691 |
0 |
0 |
0 |
0.000 |
16 |
24 |
|
[GOL]C:505 |
6 |
1 |
217 |
f |
C |
x,y,z |
1_555 |
15 |
6 |
17637 |
103.1 |
-1.1 |
0.373 |
0 |
0 |
0 |
0.025 |
17 |
25 |
|
[IMD]A:507 |
5 |
1 |
198 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
17705 |
87.5 |
2.8 |
0.231 |
1 |
0 |
0 |
0.000 |
18 |
26 |
|
[IMD]D:503 |
5 |
1 |
197 |
◊ |
C |
x,y-1,z |
1_545 |
12 |
4 |
17637 |
81.7 |
3.1 |
0.246 |
0 |
0 |
0 |
0.000 |
19 |
27 |
|
[IMD]D:503 |
5 |
1 |
197 |
f |
D |
x,y,z |
1_555 |
13 |
5 |
17589 |
78.1 |
2.7 |
0.224 |
1 |
0 |
0 |
0.000 |
20 |
28 |
|
D |
13 |
4 |
17589 |
◊ |
[GOL]A:506 |
-x-1,y-1/2,-z-1 |
2_444 |
5 |
1 |
219 |
76.9 |
0.6 |
0.618 |
3 |
0 |
0 |
0.019 |
21 |
29 |
|
[GOL]C:503 |
4 |
1 |
220 |
f |
C |
x,y,z |
1_555 |
14 |
2 |
17637 |
72.9 |
-1.8 |
0.228 |
0 |
0 |
0 |
0.090 |
30 |
|
B |
14 |
2 |
17665 |
f |
[GOL]C:502 |
-x,y-1/2,-z-1 |
2_544 |
4 |
1 |
218 |
72.9 |
-2.1 |
0.187 |
0 |
0 |
0 |
0.090 |
31 |
|
D |
15 |
3 |
17589 |
f |
[GOL]A:504 |
-x-1,y-1/2,-z-1 |
2_444 |
5 |
1 |
220 |
72.7 |
-1.8 |
0.232 |
0 |
0 |
0 |
0.090 |
32 |
|
[GOL]A:503 |
4 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
14 |
2 |
17705 |
72.1 |
-1.9 |
0.207 |
0 |
0 |
0 |
0.090 |
Average: |
72.6 |
-1.9 |
0.213 |
0 |
0 |
0 |
0.090 |
22 |
33 |
|
D |
10 |
5 |
17589 |
◊ |
[GOL]A:503 |
-x-1,y-1/2,-z-1 |
2_444 |
5 |
1 |
218 |
71.2 |
0.2 |
0.601 |
3 |
0 |
0 |
0.057 |
34 |
|
[GOL]C:502 |
5 |
1 |
218 |
◊ |
C |
x,y,z |
1_555 |
9 |
4 |
17637 |
71.0 |
0.2 |
0.601 |
3 |
0 |
0 |
0.057 |
35 |
|
[GOL]A:504 |
4 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
17705 |
70.3 |
0.1 |
0.598 |
3 |
0 |
0 |
0.057 |
36 |
|
B |
9 |
4 |
17665 |
◊ |
[GOL]C:503 |
-x,y-1/2,-z-1 |
2_544 |
4 |
1 |
220 |
70.3 |
0.1 |
0.599 |
3 |
0 |
0 |
0.057 |
Average: |
70.7 |
0.2 |
0.600 |
3 |
0 |
0 |
0.057 |
23 |
37 |
|
C |
7 |
3 |
17637 |
◊ |
A |
-x-1,y-1/2,-z-1 |
2_444 |
6 |
3 |
17705 |
65.8 |
1.6 |
0.763 |
1 |
1 |
0 |
0.000 |
38 |
|
D |
7 |
4 |
17589 |
◊ |
B |
-x,y-1/2,-z-1 |
2_544 |
5 |
3 |
17665 |
56.5 |
1.3 |
0.746 |
1 |
1 |
0 |
0.000 |
Average: |
61.2 |
1.5 |
0.754 |
1 |
1 |
0 |
0.000 |
24 |
39 |
|
[GOL]B:502 |
4 |
1 |
219 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
17705 |
61.3 |
-0.6 |
0.405 |
0 |
0 |
0 |
0.000 |
25 |
40 |
|
[IMD]C:506 |
5 |
1 |
198 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
17637 |
60.7 |
1.9 |
0.107 |
0 |
0 |
0 |
0.000 |
26 |
41 |
|
D |
8 |
3 |
17589 |
f |
[IMD]A:507 |
-x,y-1/2,-z-1 |
2_544 |
5 |
1 |
198 |
54.6 |
1.7 |
0.103 |
0 |
0 |
0 |
0.000 |
27 |
42 |
|
D |
9 |
2 |
17589 |
◊ |
[GOL]C:505 |
x,y-1,z |
1_545 |
4 |
1 |
217 |
49.5 |
-0.2 |
0.513 |
0 |
0 |
0 |
0.000 |
28 |
43 |
|
B |
7 |
3 |
17665 |
◊ |
[GOL]A:505 |
x,y-1,z |
1_545 |
5 |
1 |
216 |
48.0 |
-0.3 |
0.534 |
0 |
0 |
0 |
0.000 |
29 |
44 |
|
[GOL]C:503 |
3 |
1 |
220 |
◊ |
[GOL]C:502 |
x,y,z |
1_555 |
4 |
1 |
218 |
41.3 |
-0.3 |
0.469 |
1 |
0 |
0 |
0.018 |
45 |
|
[GOL]A:504 |
4 |
1 |
220 |
◊ |
[GOL]A:503 |
x,y,z |
1_555 |
5 |
1 |
218 |
40.9 |
-0.3 |
0.484 |
1 |
0 |
0 |
0.018 |
Average: |
41.1 |
-0.3 |
0.476 |
1 |
0 |
0 |
0.018 |
30 |
46 |
|
[IMD]C:506 |
3 |
1 |
198 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
17705 |
22.6 |
0.9 |
0.205 |
0 |
0 |
0 |
0.000 |
|