Deposited model

PDB 1O5F|dpdb_eulk018e

Deposited model

Dissecting and Designing Inhibitor Selectivity Determinants at the S1 site Using an Artificial Ala190 Protease (Ala190 uPA)

Program
X-PLOR 3.851
Model type
Deposited
Purpose
Reference
Authors
Katz, B.A., Luong, C., Ho, J.D., Somoza, J.R., Gjerstad, E., Tang, J., Williams, S.R., Verner, E., Mackman, R.L., Young, W.B., Sprengeler, P.A., Chan, H., Mortara, K., Janc, J.W., McGrath, M.E.
Atoms
3,024
Residues
358
Protein chains
2
Unmodeled fraction
2.98%
Ligand
CR9

Evaluations

R-work
0.193
R-free
0.231
Clashscore
4.7

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Serine protease hepsin114
  • Constructlight chain
  • MutationN67A
Entity 2
MoleculeChainsLengthOrganismUniProtDetails
Serine protease hepsin255
  • Constructheavy chain (catalytic domain)

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations