Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5eb3dd3b10535f1949b1b9c1622ffcd3",
"space_group_name": "P 1",
"unit_cell": {
"a": 71.58,
"b": 97.30,
"c": 99.16,
"alpha": 105.15,
"beta": 103.96,
"gamma": 100.26
},
"wavelengths": [0.93340],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [20,2.55],
"number_observations_unique": 68281,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 13.38
},
{
"type": "Completeness",
"value": 86.4
},
{
"type": "Redundancy",
"value": 2.18
}
]
},
"refln_shells": [
{
"resolution_limits": [20,11.4],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 39.03
},
{
"type": "Completeness",
"value": 79.2
}
]
},
{
"resolution_limits": [11.4,8.06],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 36.15
},
{
"type": "Completeness",
"value": 97.8
}
]
},
{
"resolution_limits": [8.06,6.58],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 26.03
},
{
"type": "Completeness",
"value": 97.2
}
]
},
{
"resolution_limits": [6.58,5.70],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 21.87
},
{
"type": "Completeness",
"value": 97.5
}
]
},
{
"resolution_limits": [5.70,5.10],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 23.35
},
{
"type": "Completeness",
"value": 97.6
}
]
},
{
"resolution_limits": [5.10,4.66],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 25.11
},
{
"type": "Completeness",
"value": 97.3
}
]
},
{
"resolution_limits": [4.66,4.31],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 25.23
},
{
"type": "Completeness",
"value": 97.5
}
]
},
{
"resolution_limits": [4.31,4.03],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 21.83
},
{
"type": "Completeness",
"value": 97.0
}
]
},
{
"resolution_limits": [4.03,3.80],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 20.52
},
{
"type": "Completeness",
"value": 80.1
}
]
},
{
"resolution_limits": [3.80,3.61],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 19.18
},
{
"type": "Completeness",
"value": 82.6
}
]
},
{
"resolution_limits": [3.61,3.44],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 14.46
},
{
"type": "Completeness",
"value": 92.2
}
]
},
{
"resolution_limits": [3.44,3.29],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "I/SigI",
"value": 12.03
},
{
"type": "Completeness",
"value": 93.7
}
]
},
{
"resolution_limits": [3.29,3.16],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.107
},
{
"type": "I/SigI",
"value": 9.82
},
{
"type": "Completeness",
"value": 96.9
}
]
},
{
"resolution_limits": [3.16,3.05],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.134
},
{
"type": "I/SigI",
"value": 7.78
},
{
"type": "Completeness",
"value": 96.9
}
]
},
{
"resolution_limits": [3.05,2.94],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
},
{
"type": "I/SigI",
"value": 6.23
},
{
"type": "Completeness",
"value": 96.6
}
]
},
{
"resolution_limits": [2.94,2.85],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.219
},
{
"type": "I/SigI",
"value": 5.00
},
{
"type": "Completeness",
"value": 96.6
}
]
},
{
"resolution_limits": [2.85,2.77],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.272
},
{
"type": "I/SigI",
"value": 4.04
},
{
"type": "Completeness",
"value": 90.4
}
]
},
{
"resolution_limits": [2.77,2.69],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.387
},
{
"type": "I/SigI",
"value": 2.90
},
{
"type": "Completeness",
"value": 71.6
}
]
},
{
"resolution_limits": [2.69,2.62],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.318
},
{
"type": "I/SigI",
"value": 3.50
},
{
"type": "Completeness",
"value": 57.9
}
]
},
{
"resolution_limits": [2.62,2.55],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.505
},
{
"type": "I/SigI",
"value": 2.16
},
{
"type": "Completeness",
"value": 51.1
}
]
}
]
}