| ## |
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 |
54 |
15 |
9259 |
◊ |
A |
x,y,z |
1_555 |
52 |
17 |
9257 |
529.0 |
-16.8 |
0.040 |
0 |
0 |
0 |
0.000 |
| 2 |
2 |
|
A |
47 |
14 |
9257 |
x |
A |
x-1/2,y+1/2,z |
3_455 |
34 |
10 |
9257 |
373.3 |
-4.5 |
0.840 |
4 |
0 |
0 |
0.000 |
3 |
|
B |
41 |
13 |
9259 |
x |
B |
x-1/2,y-1/2,z |
3_445 |
33 |
9 |
9259 |
312.1 |
-4.5 |
0.708 |
1 |
0 |
0 |
0.000 |
| Average: |
342.7 |
-4.5 |
0.774 |
3 |
0 |
0 |
0.000 |
| 3 |
4 |
|
[XX8]B:201 |
17 |
1 |
431 |
f |
B |
x,y,z |
1_555 |
57 |
17 |
9259 |
303.3 |
1.5 |
0.697 |
3 |
0 |
0 |
0.000 |
5 |
|
[XX8]A:201 |
17 |
1 |
429 |
f |
A |
x,y,z |
1_555 |
55 |
18 |
9257 |
289.9 |
2.3 |
0.706 |
4 |
0 |
0 |
0.000 |
| Average: |
296.6 |
1.9 |
0.702 |
4 |
0 |
0 |
0.000 |
| 4 |
6 |
|
[1PE]B:211 |
16 |
1 |
463 |
f |
B |
x,y,z |
1_555 |
37 |
12 |
9259 |
250.7 |
-2.6 |
0.673 |
0 |
0 |
0 |
0.105 |
| 5 |
7 |
|
[1PE]A:218 |
16 |
1 |
486 |
f |
A |
x,y,z |
1_555 |
35 |
13 |
9257 |
248.0 |
-3.7 |
0.574 |
0 |
0 |
0 |
0.000 |
| 6 |
8 |
|
[BNG]B:203 |
19 |
1 |
554 |
f |
B |
x,y,z |
1_555 |
32 |
8 |
9259 |
242.2 |
3.8 |
0.431 |
2 |
0 |
0 |
0.000 |
| 7 |
9 |
|
[BNG]A:202 |
19 |
1 |
559 |
◊ |
A |
x,y,z |
1_555 |
27 |
10 |
9257 |
226.5 |
2.0 |
0.275 |
0 |
0 |
0 |
0.000 |
| 8 |
10 |
|
[P33]B:208 |
20 |
1 |
617 |
f |
B |
-x+1,y,-z |
2_655 |
25 |
11 |
9259 |
221.9 |
-2.3 |
0.326 |
0 |
0 |
0 |
0.091 |
| 9 |
11 |
|
[PGE]A:215 |
10 |
1 |
332 |
◊ |
A |
x,y,z |
1_555 |
27 |
9 |
9257 |
173.9 |
2.7 |
0.318 |
0 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[BNG]B:202 |
17 |
1 |
554 |
◊ |
B |
x,y,z |
1_555 |
27 |
7 |
9259 |
171.9 |
2.1 |
0.340 |
1 |
0 |
0 |
0.000 |
| 11 |
13 |
|
[BNG]A:203 |
13 |
1 |
521 |
f |
A |
-x+1,y,-z+1 |
2_656 |
17 |
7 |
9257 |
165.3 |
-0.4 |
0.126 |
0 |
0 |
0 |
0.000 |
| 12 |
14 |
|
[BNG]A:204 |
15 |
1 |
545 |
f |
B |
x,y,z |
1_555 |
22 |
8 |
9259 |
164.4 |
-0.9 |
0.151 |
0 |
0 |
0 |
0.035 |
| 13 |
15 |
|
[BNG]A:203 |
15 |
1 |
521 |
◊ |
[BNG]A:203 |
-x+1,y,-z+1 |
2_656 |
15 |
1 |
521 |
163.3 |
8.2 |
0.172 |
0 |
0 |
0 |
0.000 |
| 14 |
16 |
|
[P33]B:208 |
15 |
1 |
617 |
◊ |
[P33]B:208 |
-x+1,y,-z |
2_655 |
15 |
1 |
617 |
160.7 |
-0.2 |
0.304 |
0 |
0 |
0 |
0.000 |
| 15 |
17 |
|
[PGE]B:210 |
10 |
1 |
337 |
◊ |
B |
x,y,z |
1_555 |
14 |
8 |
9259 |
157.0 |
2.6 |
0.214 |
0 |
0 |
0 |
0.000 |
| 16 |
18 |
|
[P33]B:208 |
18 |
1 |
617 |
◊ |
B |
x,y,z |
1_555 |
21 |
8 |
9259 |
154.9 |
-1.3 |
0.392 |
0 |
0 |
0 |
0.000 |
| 17 |
19 |
|
[PEG]B:206 |
7 |
1 |
259 |
f |
B |
x,y,z |
1_555 |
24 |
7 |
9259 |
154.1 |
3.8 |
0.536 |
2 |
0 |
0 |
0.000 |
| 18 |
20 |
|
[PG4]B:207 |
11 |
1 |
402 |
f |
B |
x,y,z |
1_555 |
19 |
7 |
9259 |
152.7 |
2.0 |
0.321 |
0 |
0 |
0 |
0.000 |
| 19 |
21 |
|
B |
13 |
5 |
9259 |
◊ |
B |
-x+1,y,-z |
2_655 |
13 |
5 |
9259 |
151.4 |
-4.1 |
0.211 |
0 |
0 |
0 |
0.000 |
22 |
|
A |
15 |
5 |
9257 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
15 |
5 |
9257 |
148.9 |
-3.8 |
0.384 |
0 |
0 |
0 |
0.000 |
| Average: |
150.2 |
-4.0 |
0.297 |
0 |
0 |
0 |
0.000 |
| 20 |
23 |
|
[PEG]A:212 |
7 |
1 |
258 |
f |
A |
x,y,z |
1_555 |
24 |
13 |
9257 |
150.0 |
3.3 |
0.531 |
3 |
0 |
0 |
0.000 |
| 21 |
24 |
|
[PGE]A:217 |
10 |
1 |
331 |
◊ |
A |
x,y,z |
1_555 |
13 |
7 |
9257 |
149.7 |
1.6 |
0.123 |
0 |
0 |
0 |
0.000 |
| 22 |
25 |
|
[PG0]B:204 |
8 |
1 |
297 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
9259 |
149.3 |
3.6 |
0.238 |
0 |
0 |
0 |
0.000 |
| 23 |
26 |
|
[PG4]A:213 |
12 |
1 |
407 |
◊ |
A |
x,y,z |
1_555 |
21 |
8 |
9257 |
147.7 |
2.7 |
0.331 |
2 |
0 |
0 |
0.000 |
| 24 |
27 |
|
[PG0]A:206 |
8 |
1 |
296 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
9257 |
147.4 |
3.2 |
0.295 |
0 |
0 |
0 |
0.000 |
| 25 |
28 |
|
[PEG]A:209 |
7 |
1 |
257 |
f |
A |
x,y,z |
1_555 |
23 |
6 |
9257 |
143.0 |
4.6 |
0.631 |
1 |
0 |
0 |
0.000 |
| 26 |
29 |
|
[BNG]B:203 |
14 |
1 |
554 |
◊ |
A |
x,y,z |
1_555 |
21 |
6 |
9257 |
137.0 |
0.4 |
0.174 |
0 |
0 |
0 |
0.000 |
| 27 |
30 |
|
[BNG]A:203 |
15 |
1 |
521 |
◊ |
A |
x,y,z |
1_555 |
21 |
9 |
9257 |
135.2 |
1.0 |
0.207 |
0 |
0 |
0 |
0.000 |
| 28 |
31 |
|
[PEG]A:210 |
7 |
1 |
259 |
◊ |
A |
x,y,z |
1_555 |
17 |
9 |
9257 |
131.5 |
2.1 |
0.417 |
1 |
0 |
0 |
0.000 |
| 29 |
32 |
|
[PG0]A:205 |
8 |
1 |
294 |
◊ |
A |
x,y,z |
1_555 |
15 |
6 |
9257 |
128.6 |
3.2 |
0.189 |
1 |
0 |
0 |
0.000 |
| 30 |
33 |
|
[PGE]B:209 |
9 |
1 |
332 |
◊ |
B |
x,y,z |
1_555 |
16 |
6 |
9259 |
124.6 |
2.1 |
0.236 |
0 |
0 |
0 |
0.000 |
| 31 |
34 |
|
[PGE]A:214 |
10 |
1 |
332 |
◊ |
A |
x,y,z |
1_555 |
19 |
6 |
9257 |
118.7 |
2.6 |
0.206 |
0 |
0 |
0 |
0.000 |
| 32 |
35 |
|
[PEG]A:208 |
7 |
1 |
256 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
9257 |
112.0 |
0.9 |
0.218 |
0 |
0 |
0 |
0.000 |
| 33 |
36 |
|
[BNG]B:202 |
10 |
1 |
554 |
◊ |
[BNG]A:202 |
x,y,z |
1_555 |
13 |
1 |
559 |
110.3 |
4.1 |
0.150 |
0 |
0 |
0 |
0.000 |
| 34 |
37 |
|
[PEG]A:211 |
6 |
1 |
259 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
9257 |
104.6 |
2.2 |
0.467 |
0 |
0 |
0 |
0.000 |
| 35 |
38 |
|
[PEG]A:207 |
7 |
1 |
258 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
9257 |
102.0 |
1.1 |
0.281 |
0 |
0 |
0 |
0.000 |
| 36 |
39 |
|
[BNG]A:204 |
8 |
1 |
545 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
9257 |
91.8 |
1.0 |
0.346 |
0 |
0 |
0 |
0.000 |
| 37 |
40 |
|
[1PE]B:211 |
8 |
1 |
463 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
9257 |
84.3 |
-2.0 |
0.329 |
0 |
0 |
0 |
0.000 |
| 38 |
41 |
|
[PGE]A:216 |
8 |
1 |
324 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
9257 |
74.2 |
1.0 |
0.083 |
0 |
0 |
0 |
0.000 |
| 39 |
42 |
|
[1PE]B:211 |
10 |
1 |
463 |
◊ |
[1PE]A:218 |
x,y,z |
1_555 |
8 |
1 |
486 |
73.4 |
-1.2 |
0.476 |
0 |
0 |
0 |
0.000 |
| 40 |
43 |
|
[CL]B:212 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
9259 |
71.1 |
-10.5 |
0.000 |
0 |
0 |
0 |
0.420 |
| 41 |
44 |
|
[PEG]B:205 |
4 |
1 |
253 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
9259 |
66.9 |
0.2 |
0.274 |
1 |
0 |
0 |
0.010 |
| 42 |
45 |
|
[1PE]A:218 |
9 |
1 |
486 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
9259 |
59.1 |
-1.0 |
0.364 |
0 |
0 |
0 |
0.000 |
| 43 |
46 |
|
[BNG]B:202 |
4 |
1 |
554 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
9257 |
58.5 |
-0.6 |
0.239 |
0 |
0 |
0 |
0.000 |
| 44 |
47 |
|
[PEG]B:205 |
7 |
1 |
253 |
◊ |
B |
x-1/2,y-1/2,z |
3_445 |
4 |
3 |
9259 |
56.7 |
1.2 |
0.240 |
0 |
0 |
0 |
0.000 |
| 45 |
48 |
|
[PG4]B:207 |
7 |
1 |
402 |
f |
[BNG]A:204 |
x,y,z |
1_555 |
4 |
1 |
545 |
48.9 |
0.0 |
0.095 |
1 |
0 |
0 |
0.017 |
| 46 |
49 |
|
[PEG]A:211 |
4 |
1 |
259 |
◊ |
[PEG]A:210 |
x,y,z |
1_555 |
6 |
1 |
259 |
44.9 |
2.4 |
0.122 |
0 |
0 |
0 |
0.000 |
| 47 |
50 |
|
[BNG]B:203 |
9 |
1 |
554 |
f |
[BNG]A:202 |
x,y,z |
1_555 |
5 |
1 |
559 |
43.3 |
1.4 |
0.103 |
1 |
0 |
0 |
0.000 |
| 48 |
51 |
|
[1PE]A:218 |
5 |
1 |
486 |
◊ |
[PGE]A:215 |
x,y,z |
1_555 |
4 |
1 |
332 |
42.2 |
0.6 |
0.248 |
0 |
0 |
0 |
0.000 |
| 49 |
52 |
|
[PG0]A:205 |
2 |
1 |
294 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
9259 |
41.1 |
1.0 |
0.521 |
0 |
0 |
0 |
0.000 |
| 50 |
53 |
|
[PEG]A:207 |
7 |
1 |
258 |
f |
[PG0]A:206 |
x,y,z |
1_555 |
5 |
1 |
296 |
40.1 |
1.9 |
0.033 |
0 |
0 |
0 |
0.000 |
| 51 |
54 |
|
[PEG]B:205 |
3 |
1 |
253 |
◊ |
[BNG]B:202 |
x,y,z |
1_555 |
5 |
1 |
554 |
39.5 |
1.8 |
0.237 |
0 |
0 |
0 |
0.000 |
| 52 |
55 |
|
[PEG]A:211 |
5 |
1 |
259 |
f |
[PEG]A:208 |
x,y,z |
1_555 |
3 |
1 |
256 |
39.0 |
1.9 |
0.146 |
0 |
0 |
0 |
0.000 |
| 53 |
56 |
|
[PGE]B:210 |
3 |
1 |
337 |
f |
B |
-x+1,y,-z |
2_655 |
4 |
2 |
9259 |
38.0 |
0.4 |
0.256 |
0 |
0 |
0 |
0.000 |
| 54 |
57 |
|
[PEG]A:212 |
4 |
1 |
258 |
f |
[PEG]A:209 |
x,y,z |
1_555 |
3 |
1 |
257 |
36.3 |
1.4 |
0.137 |
0 |
0 |
0 |
0.000 |
| 55 |
58 |
|
[PG0]A:205 |
3 |
1 |
294 |
◊ |
[BNG]B:203 |
x,y,z |
1_555 |
3 |
1 |
554 |
33.0 |
0.6 |
0.078 |
0 |
0 |
0 |
0.000 |
| 56 |
59 |
|
[PGE]A:217 |
3 |
1 |
331 |
f |
A |
-x+1,y,-z+1 |
2_656 |
3 |
2 |
9257 |
26.6 |
0.2 |
0.225 |
0 |
0 |
0 |
0.000 |
| 57 |
60 |
|
[P33]B:208 |
3 |
1 |
617 |
f |
[PGE]B:209 |
x,y,z |
1_555 |
4 |
1 |
332 |
26.4 |
1.3 |
0.219 |
0 |
0 |
0 |
0.000 |
| 58 |
61 |
|
[PG4]A:213 |
4 |
1 |
407 |
f |
[BNG]A:204 |
x,y,z |
1_555 |
2 |
1 |
545 |
22.9 |
1.4 |
0.319 |
0 |
0 |
0 |
0.000 |
| 59 |
62 |
|
[BNG]A:202 |
4 |
1 |
559 |
f |
B |
x,y,z |
1_555 |
4 |
1 |
9259 |
20.8 |
0.6 |
0.423 |
0 |
0 |
0 |
0.000 |
| 60 |
63 |
|
[BNG]B:203 |
3 |
1 |
554 |
◊ |
[BNG]B:202 |
x,y,z |
1_555 |
3 |
1 |
554 |
20.7 |
0.6 |
0.209 |
1 |
0 |
0 |
0.000 |
| 61 |
64 |
|
[P33]B:208 |
2 |
1 |
617 |
◊ |
[PGE]B:210 |
-x+1,y,-z |
2_655 |
1 |
1 |
337 |
20.5 |
-1.2 |
0.156 |
1 |
0 |
0 |
0.000 |
| 62 |
65 |
|
[CL]B:212 |
1 |
1 |
125 |
f |
[BNG]B:203 |
x,y,z |
1_555 |
5 |
1 |
554 |
20.1 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.058 |
| 63 |
66 |
|
[PEG]A:212 |
3 |
1 |
258 |
f |
[XX8]A:201 |
x,y,z |
1_555 |
3 |
1 |
429 |
19.8 |
0.3 |
0.176 |
0 |
0 |
0 |
0.000 |
| 64 |
67 |
|
[PGE]A:215 |
3 |
1 |
332 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
9259 |
18.9 |
0.2 |
0.154 |
0 |
0 |
0 |
0.000 |
| 65 |
68 |
|
[PGE]A:214 |
3 |
1 |
332 |
f |
A |
x-1/2,y+1/2,z |
3_455 |
2 |
1 |
9257 |
15.1 |
0.2 |
0.225 |
0 |
0 |
0 |
0.000 |
| 66 |
69 |
|
[1PE]A:218 |
2 |
1 |
486 |
◊ |
[PGE]A:214 |
x,y,z |
1_555 |
1 |
1 |
332 |
10.8 |
0.3 |
0.416 |
0 |
0 |
0 |
0.000 |
| 67 |
70 |
|
[PGE]A:215 |
1 |
1 |
332 |
f |
[BNG]A:202 |
x,y,z |
1_555 |
1 |
1 |
559 |
8.4 |
-0.3 |
0.138 |
0 |
0 |
0 |
0.013 |
| 68 |
71 |
|
[PGE]A:215 |
2 |
1 |
332 |
◊ |
[BNG]B:202 |
x,y,z |
1_555 |
1 |
1 |
554 |
7.1 |
0.3 |
0.183 |
0 |
0 |
0 |
0.000 |
| 69 |
72 |
|
[PEG]A:210 |
1 |
1 |
259 |
f |
[BNG]A:202 |
x,y,z |
1_555 |
2 |
1 |
559 |
2.5 |
-0.0 |
0.249 |
0 |
0 |
0 |
0.002 |
| 70 |
73 |
|
[PGE]A:216 |
1 |
1 |
324 |
f |
[PEG]A:210 |
x,y,z |
1_555 |
1 |
1 |
259 |
2.4 |
-0.1 |
0.239 |
0 |
0 |
0 |
0.004 |
| 71 |
74 |
|
[PGE]A:216 |
1 |
1 |
324 |
f |
[BNG]A:202 |
x,y,z |
1_555 |
1 |
1 |
559 |
1.4 |
0.1 |
0.218 |
0 |
0 |
0 |
0.000 |
| 72 |
75 |
|
A |
1 |
1 |
9257 |
f |
[PG0]A:205 |
x-1/2,y+1/2,z |
3_455 |
1 |
1 |
294 |
1.2 |
0.0 |
0.784 |
0 |
0 |
0 |
0.000 |
|