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analyze_sequence_composition

Analyze protein sequence properties like amino acid composition and hydrophobicity using a UniProt accession number to understand structural characteristics.

Instructions

Amino acid composition, hydrophobicity, and other sequence properties

Input Schema

TableJSON Schema
NameRequiredDescriptionDefault
accessionYesUniProt accession number

Implementation Reference

  • Main handler function that implements the tool logic: fetches protein sequence from UniProtKB API, calculates amino acid counts, frequencies, and categorizes residues (hydrophobic, charged, polar).
    private async handleAnalyzeSequenceComposition(args: any) {
      if (!isValidProteinInfoArgs(args)) {
        throw new McpError(ErrorCode.InvalidParams, 'Invalid sequence composition arguments');
      }
    
      try {
        const response = await this.apiClient.get(`/uniprotkb/${args.accession}`, {
          params: { format: 'json' },
        });
    
        const protein = response.data;
        const sequence = protein.sequence?.value || '';
    
        // Calculate amino acid composition
        const aaCount: { [key: string]: number } = {};
        const aaFreq: { [key: string]: number } = {};
    
        for (const aa of sequence) {
          aaCount[aa] = (aaCount[aa] || 0) + 1;
        }
    
        for (const aa in aaCount) {
          aaFreq[aa] = aaCount[aa] / sequence.length;
        }
    
        const composition = {
          accession: protein.primaryAccession,
          sequenceLength: sequence.length,
          molecularWeight: protein.sequence?.molWeight,
          aminoAcidComposition: aaCount,
          aminoAcidFrequency: aaFreq,
          hydrophobicResidues: ['A', 'I', 'L', 'M', 'F', 'W', 'Y', 'V'].reduce((sum, aa) => sum + (aaCount[aa] || 0), 0),
          chargedResidues: ['R', 'H', 'K', 'D', 'E'].reduce((sum, aa) => sum + (aaCount[aa] || 0), 0),
          polarResidues: ['S', 'T', 'N', 'Q'].reduce((sum, aa) => sum + (aaCount[aa] || 0), 0),
        };
    
        return {
          content: [
            {
              type: 'text',
              text: JSON.stringify(composition, null, 2),
            },
          ],
        };
      } catch (error) {
        return {
          content: [
            {
              type: 'text',
              text: `Error analyzing sequence composition: ${error instanceof Error ? error.message : 'Unknown error'}`,
            },
          ],
          isError: true,
        };
      }
    }
  • Input schema for the tool defining the required 'accession' parameter.
    inputSchema: {
      type: 'object',
      properties: {
        accession: { type: 'string', description: 'UniProt accession number' },
      },
      required: ['accession'],
    },
  • src/index.ts:754-755 (registration)
    Registration and dispatch of the tool handler in the CallToolRequestSchema switch statement.
    case 'analyze_sequence_composition':
      return this.handleAnalyzeSequenceComposition(args);
  • src/index.ts:547-556 (registration)
    Tool registration in the ListToolsRequestSchema response, including name, description, and schema.
      name: 'analyze_sequence_composition',
      description: 'Amino acid composition, hydrophobicity, and other sequence properties',
      inputSchema: {
        type: 'object',
        properties: {
          accession: { type: 'string', description: 'UniProt accession number' },
        },
        required: ['accession'],
      },
    },
  • Shared validation function for accession-based arguments, used in the handler for input validation.
    const isValidProteinInfoArgs = (
      args: any
    ): args is { accession: string; format?: string } => {
      return (
        typeof args === 'object' &&
        args !== null &&
        typeof args.accession === 'string' &&
        args.accession.length > 0 &&
        (args.format === undefined || ['json', 'tsv', 'fasta', 'xml'].includes(args.format))
      );
    };

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