## |
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 |
129 |
39 |
21972 |
◊ |
A |
x,y,z |
1_555 |
122 |
38 |
22367 |
1231.5 |
-11.7 |
0.206 |
8 |
8 |
0 |
0.215 |
2 |
|
D |
128 |
39 |
21619 |
◊ |
C |
x,y,z |
1_555 |
122 |
38 |
21670 |
1175.1 |
-11.2 |
0.245 |
10 |
7 |
0 |
0.215 |
Average: |
1203.3 |
-11.5 |
0.226 |
9 |
8 |
0 |
0.215 |
2 |
3 |
|
C |
92 |
28 |
21670 |
◊ |
B |
x,y,z |
1_555 |
92 |
30 |
21972 |
903.8 |
-9.6 |
0.188 |
8 |
0 |
0 |
0.134 |
4 |
|
D |
89 |
29 |
21619 |
◊ |
A |
x,y,z |
1_555 |
97 |
30 |
22367 |
893.3 |
-7.9 |
0.302 |
10 |
0 |
0 |
0.134 |
Average: |
898.6 |
-8.7 |
0.245 |
9 |
0 |
0 |
0.134 |
3 |
5 |
|
B |
62 |
22 |
21972 |
◊ |
C |
-x+1,-x+y,-z+1/3 |
6_655 |
67 |
21 |
21670 |
549.4 |
0.6 |
0.773 |
5 |
8 |
0 |
0.000 |
6 |
|
D |
61 |
19 |
21619 |
◊ |
A |
y,x-1,-z |
4_545 |
52 |
19 |
22367 |
542.1 |
0.5 |
0.785 |
6 |
6 |
0 |
0.000 |
Average: |
545.8 |
0.5 |
0.779 |
6 |
7 |
0 |
0.000 |
4 |
7 |
|
C |
44 |
16 |
21670 |
◊ |
C |
-x,-x+y,-z+1/3 |
6_555 |
43 |
16 |
21670 |
390.3 |
-1.4 |
0.631 |
2 |
2 |
0 |
0.000 |
5 |
8 |
|
A |
32 |
10 |
22367 |
◊ |
C |
-x+1,-x+y,-z+1/3 |
6_655 |
30 |
8 |
21670 |
281.3 |
-1.3 |
0.318 |
0 |
1 |
0 |
0.000 |
6 |
9 |
|
[CIT]D:601 |
12 |
1 |
308 |
f |
D |
x,y,z |
1_555 |
35 |
14 |
21619 |
219.2 |
2.6 |
0.625 |
9 |
0 |
0 |
0.018 |
7 |
10 |
|
[CIT]A:601 |
12 |
1 |
311 |
f |
A |
x,y,z |
1_555 |
33 |
15 |
22367 |
216.4 |
2.7 |
0.660 |
8 |
0 |
0 |
0.010 |
8 |
11 |
|
[CIT]B:601 |
12 |
1 |
310 |
f |
B |
x,y,z |
1_555 |
36 |
16 |
21972 |
216.1 |
1.5 |
0.550 |
7 |
0 |
0 |
0.018 |
9 |
12 |
|
[CIT]C:601 |
13 |
1 |
304 |
f |
C |
x,y,z |
1_555 |
31 |
14 |
21670 |
208.1 |
2.1 |
0.585 |
4 |
0 |
0 |
0.000 |
10 |
13 |
|
A |
21 |
8 |
22367 |
◊ |
B |
-x+1,-x+y,-z+1/3 |
6_655 |
22 |
10 |
21972 |
189.5 |
-2.5 |
0.314 |
0 |
0 |
0 |
0.000 |
11 |
14 |
|
[GOL]C:603 |
6 |
1 |
224 |
f |
C |
x,y,z |
1_555 |
23 |
11 |
21670 |
146.9 |
-0.8 |
0.512 |
4 |
0 |
0 |
0.033 |
12 |
15 |
|
[GOL]B:605 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
26 |
10 |
21972 |
145.7 |
-0.9 |
0.519 |
6 |
0 |
0 |
0.040 |
13 |
16 |
|
[GOL]A:602 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
24 |
10 |
22367 |
142.3 |
0.1 |
0.580 |
4 |
0 |
0 |
0.019 |
14 |
17 |
|
D |
10 |
4 |
21619 |
◊ |
B |
y,x-1,-z |
4_545 |
13 |
6 |
21972 |
115.1 |
-1.8 |
0.158 |
0 |
0 |
0 |
0.000 |
15 |
18 |
|
[GOL]B:602 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
21972 |
114.9 |
0.0 |
0.562 |
2 |
0 |
0 |
0.010 |
16 |
19 |
|
[GOL]A:603 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
22367 |
114.4 |
0.5 |
0.691 |
5 |
0 |
0 |
0.020 |
17 |
20 |
|
[GOL]B:603 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
17 |
6 |
21972 |
112.3 |
-0.5 |
0.536 |
2 |
0 |
0 |
0.016 |
18 |
21 |
|
[GOL]D:604 |
6 |
1 |
215 |
f |
D |
x,y,z |
1_555 |
15 |
7 |
21619 |
112.2 |
-0.4 |
0.590 |
4 |
0 |
0 |
0.028 |
19 |
22 |
|
[GOL]C:602 |
6 |
1 |
220 |
f |
C |
x,y,z |
1_555 |
16 |
7 |
21670 |
109.0 |
-0.8 |
0.495 |
0 |
0 |
0 |
0.010 |
20 |
23 |
|
[GOL]D:603 |
6 |
1 |
218 |
f |
D |
x,y,z |
1_555 |
17 |
6 |
21619 |
107.1 |
0.5 |
0.720 |
4 |
0 |
0 |
0.016 |
21 |
24 |
|
[GOL]A:605 |
6 |
1 |
224 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
22367 |
106.6 |
-1.4 |
0.318 |
2 |
0 |
0 |
0.026 |
22 |
25 |
|
D |
13 |
6 |
21619 |
◊ |
C |
y,x,-z |
4_555 |
13 |
6 |
21670 |
103.8 |
0.3 |
0.717 |
1 |
2 |
0 |
0.000 |
23 |
26 |
|
[GOL]D:605 |
6 |
1 |
225 |
f |
D |
x,y,z |
1_555 |
16 |
7 |
21619 |
101.8 |
-0.1 |
0.534 |
2 |
0 |
0 |
0.012 |
24 |
27 |
|
[GOL]D:602 |
5 |
1 |
219 |
f |
D |
x,y,z |
1_555 |
14 |
6 |
21619 |
95.4 |
0.5 |
0.698 |
6 |
0 |
0 |
0.028 |
25 |
28 |
|
[GOL]A:604 |
6 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
22367 |
90.1 |
-0.1 |
0.547 |
1 |
0 |
0 |
0.006 |
26 |
29 |
|
[GOL]B:604 |
6 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
14 |
5 |
21670 |
86.5 |
0.3 |
0.682 |
1 |
0 |
0 |
0.000 |
27 |
30 |
|
[GOL]B:604 |
5 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
21972 |
52.5 |
-0.5 |
0.456 |
0 |
0 |
0 |
0.006 |
28 |
31 |
|
[GOL]D:602 |
4 |
1 |
219 |
◊ |
C |
y,x,-z |
4_555 |
6 |
2 |
21670 |
47.1 |
-0.3 |
0.514 |
1 |
0 |
0 |
0.000 |
29 |
32 |
|
A |
5 |
2 |
22367 |
◊ |
[GOL]B:604 |
-x+1,-x+y,-z+1/3 |
6_655 |
4 |
1 |
216 |
45.7 |
0.7 |
0.701 |
2 |
0 |
0 |
0.000 |
30 |
33 |
|
[CU]B:607 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
7 |
21972 |
45.5 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.238 |
34 |
|
[CU]C:605 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
7 |
6 |
21670 |
45.1 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.238 |
35 |
|
[CU]A:606 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
6 |
6 |
22367 |
44.9 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.238 |
36 |
|
[CU]D:606 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
4 |
4 |
21619 |
44.8 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.238 |
Average: |
45.1 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.238 |
31 |
37 |
|
[CU]B:606 |
1 |
1 |
125 |
cf |
B |
x,y,z |
1_555 |
8 |
7 |
21972 |
44.9 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.236 |
38 |
|
[CU]D:607 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
4 |
4 |
21619 |
44.7 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.236 |
39 |
|
[CU]C:604 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
7 |
6 |
21670 |
44.6 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.236 |
40 |
|
[CU]A:607 |
1 |
1 |
125 |
cf |
A |
x,y,z |
1_555 |
6 |
6 |
22367 |
44.5 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.236 |
Average: |
44.7 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.236 |
32 |
41 |
|
D |
3 |
2 |
21619 |
◊ |
C |
-x,-x+y,-z+1/3 |
6_555 |
3 |
1 |
21670 |
30.0 |
-0.9 |
0.189 |
0 |
0 |
0 |
0.000 |
33 |
42 |
|
[O]C:606 |
1 |
1 |
99 |
f |
C |
x,y,z |
1_555 |
7 |
6 |
21670 |
29.2 |
0.3 |
0.000 |
0 |
0 |
0 |
0.017 |
43 |
|
[O]B:608 |
1 |
1 |
99 |
f |
B |
x,y,z |
1_555 |
8 |
7 |
21972 |
29.1 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.017 |
44 |
|
[O]A:608 |
1 |
1 |
99 |
f |
A |
x,y,z |
1_555 |
6 |
6 |
22367 |
29.0 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.017 |
45 |
|
[O]D:608 |
1 |
1 |
99 |
f |
D |
x,y,z |
1_555 |
4 |
4 |
21619 |
28.9 |
0.3 |
0.000 |
0 |
0 |
0 |
0.017 |
Average: |
29.1 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.017 |
34 |
46 |
|
[O]B:608 |
1 |
1 |
99 |
f |
[CU]B:606 |
x,y,z |
1_555 |
1 |
1 |
125 |
22.5 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.023 |
35 |
47 |
|
[O]C:606 |
1 |
1 |
99 |
f |
[CU]C:604 |
x,y,z |
1_555 |
1 |
1 |
125 |
22.1 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.025 |
36 |
48 |
|
[O]A:608 |
1 |
1 |
99 |
f |
[CU]A:607 |
x,y,z |
1_555 |
1 |
1 |
125 |
22.0 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.022 |
37 |
49 |
|
[O]D:608 |
1 |
1 |
99 |
f |
[CU]D:607 |
x,y,z |
1_555 |
1 |
1 |
125 |
21.5 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.025 |
38 |
50 |
|
[O]D:608 |
1 |
1 |
99 |
f |
[CU]D:606 |
x,y,z |
1_555 |
1 |
1 |
125 |
20.6 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.024 |
39 |
51 |
|
[O]A:608 |
1 |
1 |
99 |
f |
[CU]A:606 |
x,y,z |
1_555 |
1 |
1 |
125 |
20.4 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.022 |
40 |
52 |
|
[O]C:606 |
1 |
1 |
99 |
f |
[CU]C:605 |
x,y,z |
1_555 |
1 |
1 |
125 |
20.4 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.024 |
41 |
53 |
|
[O]B:608 |
1 |
1 |
99 |
f |
[CU]B:607 |
x,y,z |
1_555 |
1 |
1 |
125 |
20.3 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.021 |
42 |
54 |
|
[CU]A:607 |
1 |
1 |
125 |
f |
[CU]A:606 |
x,y,z |
1_555 |
1 |
1 |
125 |
15.4 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.035 |
43 |
55 |
|
[CU]C:605 |
1 |
1 |
125 |
f |
[CU]C:604 |
x,y,z |
1_555 |
1 |
1 |
125 |
15.4 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.040 |
44 |
56 |
|
[CU]B:607 |
1 |
1 |
125 |
f |
[CU]B:606 |
x,y,z |
1_555 |
1 |
1 |
125 |
14.8 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.034 |
45 |
57 |
|
[CU]D:607 |
1 |
1 |
125 |
f |
[CU]D:606 |
x,y,z |
1_555 |
1 |
1 |
125 |
14.8 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.038 |
46 |
58 |
|
D |
4 |
3 |
21619 |
◊ |
D |
y,x,-z |
4_555 |
4 |
3 |
21619 |
11.0 |
0.2 |
0.727 |
0 |
0 |
0 |
0.000 |
47 |
59 |
|
[GOL]A:603 |
1 |
1 |
221 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
21972 |
6.9 |
0.2 |
0.616 |
0 |
0 |
0 |
0.000 |
|