| ## |
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 |
107 |
34 |
12734 |
◊ |
A |
x,y,z |
1_555 |
106 |
31 |
12988 |
1048.1 |
-1.8 |
0.552 |
11 |
4 |
0 |
0.085 |
| 2 |
2 |
|
B |
91 |
28 |
12734 |
◊ |
A |
x,y,z-1 |
1_554 |
87 |
26 |
12988 |
871.7 |
-12.0 |
0.056 |
8 |
1 |
0 |
0.024 |
| 3 |
3 |
|
B |
45 |
13 |
12734 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
48 |
13 |
12988 |
445.7 |
0.1 |
0.614 |
8 |
3 |
0 |
0.000 |
| 4 |
4 |
|
B |
39 |
9 |
12734 |
◊ |
A |
-x+1,-y+1,z |
2_665 |
41 |
11 |
12988 |
388.6 |
-3.0 |
0.303 |
6 |
0 |
0 |
0.000 |
| 5 |
5 |
|
B |
20 |
6 |
12734 |
◊ |
A |
-x+2,-y+1,z |
2_765 |
19 |
5 |
12988 |
189.0 |
-0.9 |
0.480 |
3 |
0 |
0 |
0.000 |
| 6 |
6 |
|
B |
14 |
6 |
12734 |
x |
B |
-x+3/2,y-1/2,-z+1 |
3_646 |
17 |
6 |
12734 |
183.5 |
3.3 |
0.890 |
2 |
0 |
0 |
0.000 |
| 7 |
7 |
|
B |
17 |
4 |
12734 |
◊ |
A |
-x+2,-y+1,z-1 |
2_764 |
26 |
5 |
12988 |
172.6 |
-1.5 |
0.390 |
0 |
0 |
0 |
0.000 |
| 8 |
8 |
|
A |
26 |
11 |
12988 |
x |
A |
x-1/2,-y+1/2,-z+2 |
4_457 |
17 |
7 |
12988 |
162.5 |
1.2 |
0.715 |
2 |
2 |
0 |
0.000 |
| 9 |
9 |
|
[PEG]B:1229 |
7 |
1 |
258 |
◊ |
B |
x,y,z |
1_555 |
18 |
7 |
12734 |
119.9 |
2.6 |
0.297 |
2 |
0 |
0 |
0.000 |
| 10 |
10 |
|
[IMD]A:1229 |
5 |
1 |
197 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
12988 |
104.0 |
3.8 |
0.296 |
1 |
0 |
0 |
0.000 |
| 11 |
11 |
|
A |
11 |
5 |
12988 |
◊ |
A |
-x+2,-y+1,z |
2_765 |
11 |
5 |
12988 |
100.8 |
-0.2 |
0.560 |
0 |
0 |
0 |
0.000 |
12 |
|
B |
7 |
2 |
12734 |
◊ |
B |
-x+2,-y+1,z |
2_765 |
7 |
2 |
12734 |
62.2 |
-0.9 |
0.367 |
0 |
0 |
0 |
0.000 |
| Average: |
81.5 |
-0.5 |
0.463 |
0 |
0 |
0 |
0.000 |
| 12 |
13 |
|
[GOL]A:1230 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
12988 |
100.7 |
1.2 |
0.697 |
2 |
0 |
0 |
0.000 |
| 13 |
14 |
|
[PEG]B:1230 |
4 |
1 |
182 |
◊ |
B |
x,y,z |
1_555 |
14 |
6 |
12734 |
97.6 |
2.9 |
0.490 |
1 |
0 |
0 |
0.000 |
| 14 |
15 |
|
[GOL]B:1228 |
5 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
12734 |
97.2 |
0.8 |
0.705 |
2 |
0 |
0 |
0.001 |
| 15 |
16 |
|
[GOL]B:1227 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
12734 |
95.7 |
-0.3 |
0.471 |
4 |
0 |
0 |
0.024 |
| 16 |
17 |
|
[IMD]B:1226 |
5 |
1 |
197 |
f |
B |
x,y,z |
1_555 |
20 |
6 |
12734 |
95.6 |
2.4 |
0.215 |
0 |
0 |
0 |
0.000 |
| 17 |
18 |
|
[PEG]B:1229 |
5 |
1 |
258 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
12988 |
66.8 |
1.7 |
0.311 |
1 |
0 |
0 |
0.000 |
| 18 |
19 |
|
[NA]A:1224 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
12734 |
57.3 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.135 |
20 |
|
[NA]B:1224 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
12988 |
53.4 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.135 |
| Average: |
55.4 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.135 |
| 19 |
21 |
|
[NA]A:1227 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
3 |
12988 |
56.4 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.168 |
22 |
|
[NA]A:1226 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
12734 |
29.0 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.168 |
23 |
|
[NA]A:1231 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
12988 |
24.8 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.168 |
| Average: |
36.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.168 |
| 20 |
24 |
|
[CL]A:1228 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
12988 |
54.5 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.086 |
| 21 |
25 |
|
[NA]A:1225 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
11 |
3 |
12988 |
48.4 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.104 |
26 |
|
[NA]A:1225 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
12734 |
29.7 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.104 |
| Average: |
39.1 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.104 |
| 22 |
27 |
|
[NA]B:1225 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
12734 |
47.3 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.078 |
| 23 |
28 |
|
[NA]A:1226 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
12988 |
42.8 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.104 |
29 |
|
[NA]A:1231 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
12734 |
42.4 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.104 |
| Average: |
42.6 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.104 |
| 24 |
30 |
|
[GOL]B:1227 |
4 |
1 |
220 |
f |
[IMD]B:1226 |
x,y,z |
1_555 |
5 |
1 |
197 |
40.9 |
1.0 |
0.074 |
0 |
0 |
0 |
0.000 |
| 25 |
31 |
|
[NA]A:1224 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
12988 |
38.6 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.102 |
32 |
|
[NA]B:1224 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
12734 |
38.0 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.102 |
| Average: |
38.3 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.102 |
| 26 |
33 |
|
[PEG]B:1230 |
3 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
4 |
3 |
12988 |
35.4 |
0.6 |
0.486 |
0 |
0 |
0 |
0.000 |
| 27 |
34 |
|
[GOL]B:1227 |
3 |
1 |
220 |
◊ |
A |
x,y,z-1 |
1_554 |
4 |
1 |
12988 |
32.9 |
-0.4 |
0.379 |
0 |
0 |
0 |
0.000 |
| 28 |
35 |
|
[GOL]B:1227 |
3 |
1 |
220 |
f |
[NA]B:1225 |
x,y,z |
1_555 |
1 |
1 |
125 |
32.7 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.043 |
| 29 |
36 |
|
[NA]B:1231 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
12734 |
30.9 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.044 |
| 30 |
37 |
|
[GOL]B:1228 |
3 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
12988 |
25.3 |
0.1 |
0.624 |
0 |
0 |
0 |
0.000 |
| 31 |
38 |
|
[NA]B:1231 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
12988 |
25.1 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.032 |
| 32 |
39 |
|
[IMD]B:1226 |
3 |
1 |
197 |
f |
[NA]B:1225 |
x,y,z |
1_555 |
1 |
1 |
125 |
23.9 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.019 |
| 33 |
40 |
|
[NA]A:1231 |
1 |
1 |
125 |
f |
[NA]A:1227 |
x,y,z |
1_555 |
1 |
1 |
125 |
17.7 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.041 |
| 34 |
41 |
|
B |
1 |
1 |
12734 |
f |
[IMD]A:1229 |
x,y,z-1 |
1_554 |
3 |
1 |
197 |
17.0 |
0.3 |
0.083 |
0 |
0 |
0 |
0.000 |
| 35 |
42 |
|
[NA]A:1231 |
1 |
1 |
125 |
◊ |
[NA]A:1225 |
x,y,z |
1_555 |
1 |
1 |
125 |
15.9 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.031 |
| 36 |
43 |
|
[NA]B:1231 |
1 |
1 |
125 |
◊ |
[NA]B:1224 |
x,y,z |
1_555 |
1 |
1 |
125 |
15.7 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.036 |
| 37 |
44 |
|
[NA]A:1227 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
12734 |
15.6 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.021 |
| 38 |
45 |
|
A |
5 |
3 |
12988 |
◊ |
A |
-x+1,-y+1,z |
2_665 |
5 |
3 |
12988 |
12.4 |
-0.2 |
0.533 |
0 |
0 |
0 |
0.000 |
| 39 |
46 |
|
[NA]B:1224 |
1 |
1 |
125 |
◊ |
[NA]A:1226 |
x,y,z |
1_555 |
1 |
1 |
125 |
11.8 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.027 |
| 40 |
47 |
|
[NA]A:1231 |
1 |
1 |
125 |
◊ |
[NA]A:1224 |
x,y,z |
1_555 |
1 |
1 |
125 |
11.1 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.026 |
| 41 |
48 |
|
[PEG]B:1230 |
3 |
1 |
182 |
f |
[NA]A:1231 |
x,y,z |
1_555 |
1 |
1 |
125 |
10.1 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.009 |
| 42 |
49 |
|
[PEG]B:1229 |
4 |
1 |
258 |
f |
A |
-x+1,-y+1,z |
2_665 |
1 |
1 |
12988 |
7.8 |
0.5 |
0.272 |
0 |
0 |
0 |
0.000 |
| 43 |
50 |
|
[PEG]B:1230 |
1 |
1 |
182 |
f |
[NA]A:1227 |
x,y,z |
1_555 |
1 |
1 |
125 |
6.7 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.006 |
| 44 |
51 |
|
[NA]A:1227 |
1 |
1 |
125 |
◊ |
[NA]A:1225 |
x,y,z |
1_555 |
1 |
1 |
125 |
5.7 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.011 |
| 45 |
52 |
|
[NA]B:1225 |
1 |
1 |
125 |
◊ |
A |
x,y,z-1 |
1_554 |
1 |
1 |
12988 |
2.1 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
| 46 |
53 |
|
[CL]A:1228 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
12734 |
1.5 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.001 |
|