## |
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 |
511 |
131 |
20902 |
◊ |
C |
x,y,z |
1_555 |
532 |
134 |
38129 |
4894.4 |
-30.8 |
0.094 |
78 |
35 |
0 |
0.301 |
2 |
|
B |
511 |
131 |
20956 |
◊ |
A |
x,y,z |
1_555 |
533 |
133 |
38106 |
4869.5 |
-32.9 |
0.077 |
73 |
33 |
0 |
0.301 |
Average: |
4882.0 |
-31.8 |
0.086 |
76 |
34 |
0 |
0.301 |
2 |
3 |
|
A |
141 |
36 |
38106 |
◊ |
C |
x-1/2,-y+1/2,-z+1/2 |
8_455 |
142 |
37 |
38129 |
1275.0 |
1.2 |
0.685 |
16 |
3 |
0 |
0.013 |
3 |
4 |
|
D |
102 |
27 |
20902 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
110 |
27 |
20956 |
1017.4 |
-10.8 |
0.162 |
9 |
1 |
0 |
0.082 |
4 |
5 |
|
[MGD]A:5801 |
47 |
1 |
944 |
f |
A |
x,y,z |
1_555 |
102 |
38 |
38106 |
616.7 |
-9.4 |
0.556 |
23 |
0 |
0 |
0.090 |
6 |
|
[MGD]C:7801 |
47 |
1 |
946 |
f |
C |
x,y,z |
1_555 |
102 |
39 |
38129 |
616.3 |
-10.9 |
0.435 |
23 |
0 |
0 |
0.090 |
Average: |
616.5 |
-10.2 |
0.496 |
23 |
0 |
0 |
0.090 |
5 |
7 |
|
[MGD]C:7802 |
47 |
1 |
918 |
f |
C |
x,y,z |
1_555 |
96 |
41 |
38129 |
612.0 |
-12.1 |
0.333 |
19 |
0 |
0 |
0.088 |
8 |
|
[MGD]A:5802 |
46 |
1 |
920 |
f |
A |
x,y,z |
1_555 |
92 |
38 |
38106 |
608.0 |
-12.2 |
0.337 |
19 |
0 |
0 |
0.088 |
Average: |
610.0 |
-12.1 |
0.335 |
19 |
0 |
0 |
0.088 |
6 |
9 |
|
B |
62 |
19 |
20956 |
◊ |
C |
x-1/2,-y+1/2,-z+1/2 |
8_455 |
64 |
20 |
38129 |
549.6 |
-3.3 |
0.372 |
5 |
1 |
0 |
0.023 |
10 |
|
A |
61 |
18 |
38106 |
◊ |
D |
x-1/2,-y+1/2,-z+1/2 |
8_455 |
58 |
19 |
20902 |
539.4 |
-2.3 |
0.459 |
7 |
1 |
0 |
0.023 |
Average: |
544.5 |
-2.8 |
0.415 |
6 |
1 |
0 |
0.023 |
7 |
11 |
|
C |
35 |
10 |
38129 |
◊ |
B |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
34 |
11 |
20956 |
341.1 |
-4.2 |
0.153 |
5 |
5 |
0 |
0.014 |
8 |
12 |
|
[SF4]A:5807 |
8 |
1 |
306 |
f |
A |
x,y,z |
1_555 |
30 |
15 |
38106 |
190.5 |
-21.1 |
0.271 |
3 |
0 |
0 |
0.096 |
13 |
|
[SF4]C:7807 |
8 |
1 |
305 |
f |
C |
x,y,z |
1_555 |
29 |
15 |
38129 |
189.2 |
-21.0 |
0.278 |
3 |
0 |
0 |
0.096 |
Average: |
189.8 |
-21.1 |
0.274 |
3 |
0 |
0 |
0.096 |
9 |
14 |
|
[SF4]D:7805 |
8 |
1 |
307 |
f |
D |
x,y,z |
1_555 |
24 |
15 |
20902 |
186.7 |
-21.6 |
0.276 |
1 |
0 |
0 |
0.242 |
15 |
|
[SF4]B:5805 |
8 |
1 |
306 |
f |
B |
x,y,z |
1_555 |
26 |
15 |
20956 |
185.1 |
-21.6 |
0.320 |
1 |
0 |
0 |
0.242 |
Average: |
185.9 |
-21.6 |
0.298 |
1 |
0 |
0 |
0.242 |
10 |
16 |
|
[F3S]B:5808 |
7 |
1 |
306 |
f |
B |
x,y,z |
1_555 |
29 |
13 |
20956 |
186.2 |
-19.1 |
0.494 |
3 |
0 |
0 |
0.224 |
17 |
|
[F3S]D:7808 |
7 |
1 |
303 |
f |
D |
x,y,z |
1_555 |
28 |
14 |
20902 |
184.3 |
-18.9 |
0.426 |
3 |
0 |
0 |
0.224 |
Average: |
185.2 |
-19.0 |
0.460 |
3 |
0 |
0 |
0.224 |
11 |
18 |
|
D |
26 |
7 |
20902 |
◊ |
A |
x,y,z |
1_555 |
20 |
7 |
38106 |
184.1 |
-0.6 |
0.541 |
1 |
0 |
0 |
0.000 |
12 |
19 |
|
[SF4]B:5800 |
8 |
1 |
306 |
f |
B |
x,y,z |
1_555 |
24 |
12 |
20956 |
181.6 |
-21.3 |
0.319 |
0 |
0 |
0 |
0.234 |
20 |
|
[SF4]D:7800 |
8 |
1 |
305 |
f |
D |
x,y,z |
1_555 |
24 |
12 |
20902 |
181.3 |
-21.3 |
0.342 |
0 |
0 |
0 |
0.234 |
Average: |
181.5 |
-21.3 |
0.330 |
0 |
0 |
0 |
0.234 |
13 |
21 |
|
[SF4]B:5806 |
8 |
1 |
305 |
f |
B |
x,y,z |
1_555 |
24 |
14 |
20956 |
179.9 |
-18.6 |
0.723 |
1 |
0 |
0 |
0.218 |
22 |
|
[SF4]D:7806 |
8 |
1 |
306 |
f |
D |
x,y,z |
1_555 |
24 |
14 |
20902 |
179.7 |
-19.6 |
0.614 |
2 |
0 |
0 |
0.218 |
Average: |
179.8 |
-19.1 |
0.668 |
2 |
0 |
0 |
0.218 |
14 |
23 |
|
C |
12 |
4 |
38129 |
◊ |
A |
x,y,z |
1_555 |
17 |
7 |
38106 |
127.6 |
1.5 |
0.800 |
1 |
0 |
0 |
0.000 |
15 |
24 |
|
A |
15 |
5 |
38106 |
x |
A |
x-1/2,-y+1/2,-z+1/2 |
8_455 |
14 |
6 |
38106 |
92.7 |
0.3 |
0.590 |
0 |
1 |
0 |
0.000 |
16 |
25 |
|
[MO]C:7803 |
1 |
1 |
163 |
f |
C |
x,y,z |
1_555 |
19 |
9 |
38129 |
60.7 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.019 |
26 |
|
[MO]A:5803 |
1 |
1 |
163 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
38106 |
58.9 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.019 |
Average: |
59.8 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.019 |
17 |
27 |
|
[MGD]A:5802 |
4 |
1 |
920 |
f |
[MGD]A:5801 |
x,y,z |
1_555 |
3 |
1 |
944 |
48.0 |
-3.9 |
0.193 |
2 |
0 |
0 |
0.021 |
28 |
|
[MGD]C:7802 |
3 |
1 |
918 |
f |
[MGD]C:7801 |
x,y,z |
1_555 |
3 |
1 |
946 |
47.0 |
-3.8 |
0.176 |
2 |
0 |
0 |
0.021 |
Average: |
47.5 |
-3.9 |
0.184 |
2 |
0 |
0 |
0.021 |
18 |
29 |
|
[MGD]C:7801 |
3 |
1 |
946 |
f |
[MO]C:7803 |
x,y,z |
1_555 |
1 |
1 |
163 |
44.3 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.034 |
30 |
|
[MGD]A:5801 |
3 |
1 |
944 |
f |
[MO]A:5803 |
x,y,z |
1_555 |
1 |
1 |
163 |
44.3 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.034 |
31 |
|
[MGD]A:5802 |
4 |
1 |
920 |
f |
[MO]A:5803 |
x,y,z |
1_555 |
1 |
1 |
163 |
44.0 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.034 |
32 |
|
[MGD]C:7802 |
3 |
1 |
918 |
f |
[MO]C:7803 |
x,y,z |
1_555 |
1 |
1 |
163 |
43.6 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.034 |
Average: |
44.1 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.034 |
19 |
33 |
|
C |
2 |
1 |
38129 |
◊ |
C |
-x,-y,z |
2_555 |
2 |
1 |
38129 |
3.7 |
-0.0 |
0.595 |
0 |
0 |
0 |
0.000 |
20 |
34 |
|
[SF4]D:7806 |
1 |
1 |
306 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
38129 |
3.1 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.002 |
35 |
|
[SF4]B:5806 |
1 |
1 |
305 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
38106 |
2.1 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.002 |
Average: |
2.6 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.002 |
|