--- tags: - antibody - antigen - binding - COVID-19 - SARS-CoV-2 - benchmark pretty_name: CoV-UniBind ---

CoV-UniBind - Coronavirus Unified Binding Database

Description

**CoV-UniBind** curates and integrates structural and biochemical data on antibodies specifically elicited by SARS-CoV-2 and related coronaviruses. It links 3D antibody structures to their binding properties across viral variants, incorporating epitope and sequence information. This dataset serves as a comprehensive resource for analysing antibody-antigen interactions in the context of COVID-19 and provides a foundation for binding classification and regression tasks using deep learning models. ## Database Overview | Dataset | Description | Label | Type | References (doi) | |------|-------------|-------|-----| ------- | | covabdab | Binding labels from the Coronavirus Antibody Database (CoV-AbDab) | binding | bool | 10.1093/bioinformatics/btaa739 | | dms_bloom | Deep Mutational Scanning escape data from Greaney et al. 2022 | escape | float | 10.1038/s41564-021-00972-2; 10.1016/j.chom.2020.11.007; 10.1038/s41467-021-24435-8; 10.1016/j.xcrm.2021.100255; 10.1126/science.abf9302; 10.1038/s41467-021-24435-8; 10.1038/s41564-021-00972-2; 10.1038/s41586-021-04385-3; 10.1038/s41586-022-04980-y; 10.1038/s41586-021-03817-4; 10.1038/s41586-021-03807-6 | | dms_cao | Deep Mutational Scanning escape data from Cao et al. 2023 | escape | float | 10.1038/s41586-022-05644-7 | | jian_elisa | ELISA antibody IC50 measurements from Jian et al. 2025 | IC50 | float | 10.1038/s41586-024-08315-x | | spr | Surface Plasmon Resonance antibody affinity measurements from multiple sources | KD | float | 10.1038/s41467-024-54916-5; 10.1038/s41586-020-2380-z; 10.1038/s41467-021-24514-w; 10.1016/j.immuni.2022.06.005; 10.1016/j.xcrm.2023.100991 | | drdb | Neutralisation potency data from the SARS-CoV-2 Resistance Database (DRDB) | IC50 | float | 10.1371/journal.pone.0261045 | ## Database Structure ``` . ├── antibody_info │ └── antibody_synonyms.csv ├── data │ ├── covabdab_binding.parquet │ │ └── structures │ │ ├── processed.zip │ │ └── trimmed.zip │ ├── dms_bloom_ab_escape.parquet │ ├── dms_cao_ab_escape.parquet │ ├── drdb_binding_potency.parquet │ ├── jian_elisa_ab_ic50.parquet │ └── spr_ab_affinity.parquet ├── scores │ ├── covabdab_binding_scores.parquet │ ├── dms_bloom_ab_escape_scores.parquet │ ├── dms_cao_ab_escape_scores.parquet │ ├── drdb_binding_potency_scores.parquet │ ├── jian_elisa_ab_ic50_scores.parquet │ └── spr_ab_affinity_scores.parquet ├── cov-unibind.py └── README.md ``` ## Usage Guide ```python from datasets import load_dataset data='drbd' # specify the dataset name based on table above dataset = load_dataset("InstaDeepAI/cov-unibind",name=data) ``` ## Dataset Schema The table below includes information about the columns contained in the datasets. | Column Name | Description | Type | Nullable | Example | |---|---|---|---|---| | `antibody_name` | Name of the antibody | *str* | False | `bd30_515;bd_515` | | `antigen_lineage` | Antigen lineage | *str* | False | `BA.1` | | `target_value` | Experimental binding value| *float* or *bool* | False | `-2.327902` or `True` | | `target_type` | Type of target value | *str* | False | `IC50_log10_fold` | | `source_name` | Source of the data | *str* | False | `jian_2024_nature` | | `source_doi` | DOI of the source | *str* | False | `10.1038/s41586-024-08315-x` | | `assay_name` | Name of the assay | *str* | False | `elisa` | | `pdb_id` | PDB structure ID | *str* | False | `7e88` | | `structure_release_date` | Release date of the structure | *str* | False | `03/01/21` | | `structure_resolution` | Resolution of the structure (Å) | *float* | False | `3.14` | | `mutations` | Lineage consensus mutations | *str* | False | `A67V H69- V70- T95I...` | | `antigen_chain_ids` | Chain IDs of the antigen | *str* | False | `C` | | `antigen_domain` | Domain of the antigen | *str* | False | `RBD` | | `antigen_residue_indices` | Residue indices of the antigen | *str* | False | `(13, 568)` | | `antigen_residue_indices_trimmed` | Antigen residue indices, trimmed | *float* | True | `(333, 526)` | | `antigen_host` | Host organism of the antigen | *str* | False | `severe acute respiratory syndrome coronavirus 2 (2697049)` | | `antibody_heavy_chain_id` | Heavy chain ID of the antibody | *str* | False | `C` | | `antibody_light_chain_id` | Light chain ID of the antibody | *str* | False | `B` | | `epitope_residues` | Residues of the epitope | *str* | False | `R403 D405 T415` | | `epitope_mutations` | PDB antigen mutations in the epitope | *str* | True | `D405T` | | `epitope_domain` | Spike domain where the antibody binds | *str* | False | `RBD` | | `epitope_alteration_count` | Number of alterations in the epitope | *float* | True | `2` | | `spike_sequence` | Full spike protein sequence | *str* | False | `MFVFLVLLPLVSSQCVNLTTRTQL...` | | `antibody_heavy_chain_sequence` | Sequence of the antibody heavy chain | *str* | False | `EVQLVESGGGLVQPGGSLRLSCAASEFIVSRNYMSWVR...` | | `antibody_light_chain_sequence` | Sequence of the antibody light chain | *str* | False | `DIQMTQSPSSLSASVGDRVTITCQASQDINKYLNWYQQK...` | | `antibody_vh_sequence` | Sequence of the VH domain | *str* | False | `EVQLVESGGGLVQPGGSLRLSCAASEFIVSRNYMSWVRQ...` | | `antibody_vl_sequence` | Sequence of the VL domain | *str* | False | `DIQMTQSPSSLSASVGDRVTITCQASQDINKYLNW...` | | `antigen_sequence` | Full antigen sequence | *str* | False | `TNLCPFDEVF-NATRFASVYAWNR--KRISNCVADYSVLYNLAPFFTFKCYGVSP...` | | `antigen_sequence_trimmed` | Trimmed antigen sequence | *float* | True | `TRFASV-YAWNRKRISNCVADYSVLYNLAPFFT-FKCYGVSP...` | | `antigen_sequence_without_indels`| Antigen sequence without insertions/deletions | *str* | False | `TNLCPFDEVFNATRFASVYAWNRKRISNCVAD...` | | `antigen_sequence_trimmed_without_indels` | Trimmed antigen sequence without insertions/deletions | *float* | True | `NATRFASVYAWNRKRISNCVAD...` | | `antigen_pdb_sequence` | Antigen sequence from PDB | *str* | False | `TNLCPFGEVFNATRFASVYAWNRKRISNCVADYSVLYNSA...` | | `antigen_pdb_sequence_trimmed` | Trimmed antigen sequence from PDB | *float* | True | `NATRFASVYAWNRKRISNCVADYSVLYNSA...` | ## Acknowledgments This project makes use of publicly available antibody datasets listed above. We acknowledge the contributions by the teams responsible for compiling and maintaining these valuable resources.