Research section Research projects and references

Research: Β-LACTMASES Folding Project #16454

Project #16454 overview

Project Summary AI Beta

This project looks at ancient enzymes called beta-lactamases that break down penicillin. By studying an old version of this enzyme, scientists hope to find hidden pockets that could be targeted by new drugs to fight antibiotic resistance.
Automated summary; simplified and may not be fully accurate.

Project team

Manager(s)
Sukrit Singh
Institution
Washington University in St. Louis

Work unit

Atoms
33,296
Core
GRO_A7
Status
Public

No related projects listed.

Source material

Official Project Description

This project studies the R241F mutant of Tem-1 β-Lactmase β-Lactmases are enzymes which break down penicillin-like antibiotics.

This is the most common method by which bacteria become resistant to such antibiotics.

This project is simulating the most probable common ancestor (dating back to around 2 billion years ago) of modern day Gram Negative beta-lactamases.

We hope to understand the funtional significance of various cryptic pockets found in these enzymes by comparing these results to simulations of modern beta-lactamases.

Finding such functional pockets could enable us to target these enzymes with drugs that might combat this form of antibiotic resistance.

Performance data

Hardware Performance for Project 16454

Compare community-sampled Folding@Home output for the GPUs and CPUs processing this project.

Data as of Sunday, 02 August 2026 22:03:06

GPU PPD Averages

Rank
Project
Model Name
Folding@Home Identifier
Make
Brand
GPU
Model
PPD
Average
Points WU
Average
WUs Day
Average
WU Time
Average
1 HD Graphics 4000
[HD Graphics 4000]
Intel 657 514 1.28 18 hrs 47 mins

CPU PPD Averages Beta

Rank
Project
CPU Model Logical
Processors (LP)
PPD-PLP
AVG PPD per 1 LP
ALL LP-PPD
(Estimated)
Make
1 RYZEN THREADRIPPER 3960X 24-CORE 48 12,484 599,232 AMD
2 RYZEN 9 3950X 16-CORE 32 12,521 400,672 AMD
3 RYZEN 9 3900X 12-CORE 24 12,477 299,448 AMD
4 RYZEN 9 3900XT 12-CORE 24 9,609 230,616 AMD
5 RYZEN 7 5800X 8-CORE 16 12,812 204,992 AMD
6 CORE I9-10980XE CPU @ 3.00GHZ 36 5,620 202,320 Intel
7 XEON CPU E5-2686 V4 @ 2.30GHZ 36 4,866 175,176 Intel
8 RYZEN 7 3700X 8-CORE 16 10,677 170,832 AMD
9 CORE I9-7920X CPU @ 2.90GHZ 24 6,855 164,520 Intel
10 RYZEN THREADRIPPER 1920X 12-CORE 24 6,680 160,320 AMD
11 CORE I9-9900KF CPU @ 3.60GHZ 16 10,016 160,256 Intel
12 CORE I9-10900X CPU @ 3.70GHZ 20 7,425 148,500 Intel
13 CORE I9-9900K CPU @ 3.60GHZ 16 9,231 147,696 Intel
14 CORE I9-7940X CPU @ 3.10GHZ 28 4,471 125,188 Intel
15 RYZEN 5 3600 6-CORE 12 10,110 121,320 AMD
16 CORE I7-8700K CPU @ 3.70GHZ 12 9,379 112,548 Intel
17 RYZEN 5 3600X 6-CORE 12 8,457 101,484 AMD
18 XEON CPU E5-2660 0 @ 2.20GHZ 32 3,098 99,136 Intel
19 RYZEN 7 2700X EIGHT-CORE 16 4,950 79,200 AMD
20 RYZEN 5 2600X SIX-CORE 12 5,717 68,604 AMD
21 XEON CPU E5-2690 V2 @ 3.00GHZ 20 3,403 68,060 Intel
22 RYZEN 5 2600 SIX-CORE 12 5,556 66,672 AMD
23 CORE I3-10100 CPU @ 3.60GHZ 8 7,152 57,216 Intel
24 CORE I5-9400 CPU @ 2.90GHZ 6 8,314 49,884 Intel
25 CORE I7-4790K CPU @ 4.00GHZ 8 5,734 45,872 Intel
26 PHENOM II X6 1090T 6 3,995 23,970 AMD
27 RYZEN 5 3500U 8 1,050 8,400 AMD
28 CORE2 DUO CPU T8100 @ 2.10GHZ 2 1,255 2,510 Intel