Docked structure between SUMO1 and ZZ-domain from CBP
MSDQEAKPST EDLGDKKEGE YIKLKVIGQD SSEIHFKVKM TTHLKKLKES YCQRQGVPMN SLRFLFEGQR IADNHTPKEL GMEEEDVIEV YQEQTGHSTV
ID | Type | Value order | Atom ID 1 | Atom ID 2 |
---|---|---|---|---|
1 | metal coordination | sing | 2:CYS9:SG | 3:ZN1:ZN |
2 | metal coordination | sing | 2:CYS12:SG | 3:ZN1:ZN |
3 | metal coordination | sing | 2:CYS22:SG | 3:ZN1:ZN |
4 | metal coordination | sing | 2:CYS25:SG | 3:ZN1:ZN |
5 | metal coordination | sing | 2:CYS31:SG | 3:ZN1:ZN |
6 | metal coordination | sing | 2:CYS34:SG | 3:ZN1:ZN |
7 | metal coordination | sing | 2:HIS40:NE2 | 3:ZN1:ZN |
8 | metal coordination | sing | 2:HIS42:NE2 | 3:ZN1:ZN |
Polymer type: polypeptide(L)
Total | 1H | 13C | 15N | |
---|---|---|---|---|
All | 11.7 % (211 of 1803) | 10.1 % (95 of 944) | 3.5 % (24 of 694) | 55.8 % (92 of 165) |
Backbone | 22.9 % (209 of 912) | 29.7 % (93 of 313) | 5.3 % (24 of 449) | 61.3 % (92 of 150) |
Sidechain | 1.2 % (12 of 1034) | 0.3 % (2 of 631) | 2.6 % (10 of 388) | 0.0 % (0 of 15) |
Aromatic | 0.0 % (0 of 148) | 0.0 % (0 of 74) | 0.0 % (0 of 72) | 0.0 % (0 of 2) |
Methyl | 0.0 % (0 of 130) | 0.0 % (0 of 65) | 0.0 % (0 of 65) |
1. entity 1
MSDQEAKPST EDLGDKKEGE YIKLKVIGQD SSEIHFKVKM TTHLKKLKES YCQRQGVPMN SLRFLFEGQR IADNHTPKEL GMEEEDVIEV YQEQTGHSTV2. entity 2
GQDRFVYTCN ECKHHVETRW HCTVCEDYDL CINCYNTKSH AHKMVKWGLG LDDSolvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 298 K, pH 6, Details 20 mM MES pH 6.0, 90% H2O, 10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | entity_1 | protein | 0.0 ~ 0.0 mM | |
2 | entity_2 | protein | 0.0 ~ 0.0 mM | |
3 | MES | natural abundance | buffer | 20 mM |
4 | H2O | natural abundance | solvent | 93 % |
5 | D2O | [U-2H] | solvent | 7 % |
Solvent system 90% H2O, 10% D2O, Pressure 1 atm, Temperature 298 K, pH 6, Details 20 mM MES pH 6.0, 90% H2O, 10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
6 | entity_1 | protein | 0.0 ~ 0.0 mM | |
7 | entity_2 | protein | 0.0 ~ 0.0 mM | |
8 | MES | natural abundance | buffer | 20 mM |
9 | H2O | natural abundance | solvent | 90 % |
10 | D2O | [U-2H] | solvent | 10 % |